Anonymous-07/SafeChem · Datasets at Hugging Face

10,12-PENTACOSADIYNOIC ACID

066990-32-7

538,433

pentacosa-10,12-diynoic acid

CCCCCCCCCCCCC#CC#CCCCCCCCCC(=O)O

InChI=1S/C25H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25(26)27/h2-12,17-24H2,1H3,(H,26,27)

ZPUDRBWHCWYMQS-UHFFFAOYSA-N

C25H42O2

374.6

374.318481

9.4

37.3

466

0

1

2

19

27

null

0

1

0

1

0

1

2-KETO-N-BUTYRIC ACID SODIUM SALT

002013-26-5

23,673,454

sodium 2-oxobutanoate

CCC(=O)C(=O)[O-].[Na+]

InChI=1S/C4H6O3.Na/c1-2-3(5)4(6)7;/h2H2,1H3,(H,6,7);/q;+1/p-1

SUAMAHKUSIHRMR-UHFFFAOYSA-M

C4H5NaO3

124.07

124.013638

null

57.2

99

0

3

2

8

null

0

1

0

1

0

1

DIETHYL(BROMODIFLUOROMETHYL)PHOSPHONATE

065094-22-6

144,101

1-[[bromo(difluoro)methyl]-ethoxyphosphoryl]oxyethane

CCOP(=O)(C(F)(F)Br)OCC

InChI=1S/C5H10BrF2O3P/c1-3-10-12(9,11-4-2)5(6,7)8/h3-4H2,1-2H3

QRADKVYIJIAENZ-UHFFFAOYSA-N

C5H10BrF2O3P

267.01

265.9519

1.8

35.5

178

0

5

12

null

0

1

0

1

0

1

(R)-(+)-2-(TERT-BUTOXYCARBONYLAMINO)-1-PROPANOL

106391-86-0

13,200,309

tert-butyl N-[(2R)-1-hydroxypropan-2-yl]carbamate

C[C@H](CO)NC(=O)OC(C)(C)C

InChI=1S/C8H17NO3/c1-6(5-10)9-7(11)12-8(2,3)4/h6,10H,5H2,1-4H3,(H,9,11)/t6-/m1/s1

PDAFIZPRSXHMCO-ZCFIWIBFSA-N

C8H17NO3

175.23

175.120843

0.7

58.6

151

0

2

3

4

12

null

0

1

0

1

0

1

(S)-(-)-2-(TERT-BUTOXYCARBONYLAMINO)-1-PROPANOL

079069-13-9

7,023,103

tert-butyl N-[(2S)-1-hydroxypropan-2-yl]carbamate

C[C@@H](CO)NC(=O)OC(C)(C)C

InChI=1S/C8H17NO3/c1-6(5-10)9-7(11)12-8(2,3)4/h6,10H,5H2,1-4H3,(H,9,11)/t6-/m0/s1

PDAFIZPRSXHMCO-LURJTMIESA-N

C8H17NO3

175.23

175.120843

0.7

58.6

151

0

2

3

4

12

null

0

1

0

1

0

1

2-BROMOHEXADECANOIC ACID

018263-25-7

82,145

2-bromohexadecanoic acid

CCCCCCCCCCCCCCC(C(=O)O)Br

InChI=1S/C16H31BrO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(17)16(18)19/h15H,2-14H2,1H3,(H,18,19)

DPRAYRYQQAXQPE-UHFFFAOYSA-N

C16H31BrO2

335.32

334.15074

7.8

37.3

207

0

1

2

14

19

null

0

1

0

1

0

1

ERBIUM (III) PHOSPHATE HYDRATE

014242-01-4

16,217,375

erbium(3+);phosphate;hydrate

O.[O-]P(=O)([O-])[O-].[Er+3]

InChI=1S/Er.H3O4P.H2O/c;1-5(2,3)4;/h;(H3,1,2,3,4);1H2/q+3;;/p-3

PDQXJPLNEUYGOX-UHFFFAOYSA-K

ErH2O5P

280.25

278.894286

null

87.3

36

0

1

5

0

7

null

0

1

0

1

0

1

PRASEODYMIUM (III) PHOSPHATE

014298-31-8

3,084,189

praseodymium(3+) phosphate

[O-]P(=O)([O-])[O-].[Pr+3]

InChI=1S/H3O4P.Pr/c1-5(2,3)4;/h(H3,1,2,3,4);/q;+3/p-3

KDCUNMWWJBHRSC-UHFFFAOYSA-K

O4PPr

235.879

235.86108

null

86.3

36

0

4

0

6

null

0

1

0

1

0

1

NEODYMIUM(III) PHOSPHATE HYDRATE

014298-32-9

167,060

neodymium(3+) phosphate

[O-]P(=O)([O-])[O-].[Nd+3]

InChI=1S/Nd.H3O4P/c;1-5(2,3)4/h;(H3,1,2,3,4)/q+3;/p-3

DZNFWGVDYGAMJB-UHFFFAOYSA-K

NdO4P

239.21

236.86115

null

86.3

36

0

4

0

6

null

0

1

0

1

0

1

SAMARIUM(III) PHOSPHATE HYDRATE

013465-57-1

13,710,715

samarium(3+) phosphate

[O-]P(=O)([O-])[O-].[Sm+3]

InChI=1S/H3O4P.Sm/c1-5(2,3)4;/h(H3,1,2,3,4);/q;+3/p-3

BJRVEOKYZKROCC-UHFFFAOYSA-K

O4PSm

245.3

246.87316

null

86.3

36

0

4

0

6

null

0

1

0

1

0

1

18-PENTATRIACONTANONE

000504-53-0

10,440

pentatriacontan-18-one

CCCCCCCCCCCCCCCCCC(=O)CCCCCCCCCCCCCCCCC

InChI=1S/C35H70O/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35(36)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-34H2,1-2H3

DMCJFWXGXUEHFD-UHFFFAOYSA-N

C35H70O

506.9

506.542667

16.8

17.1

365

0

1

32

36

null

0

1

0

1

0

1

4-KETOPIMELIC ACID

000502-50-1

95,084

4-oxoheptanedioic acid

C(CC(=O)O)C(=O)CCC(=O)O

InChI=1S/C7H10O5/c8-5(1-3-6(9)10)2-4-7(11)12/h1-4H2,(H,9,10)(H,11,12)

UDDSEESQRGPVIL-UHFFFAOYSA-N

C7H10O5

174.15

174.052823

-1.2

91.7

176

0

2

5

6

12

null

0

1

0

1

0

1

4-MERCAPTO-1-BUTANOL

014970-83-3

548,261

4-sulfanylbutan-1-ol

C(CCS)CO

InChI=1S/C4H10OS/c5-3-1-2-4-6/h5-6H,1-4H2

NEJMTSWXTZREOC-UHFFFAOYSA-N

C4H10OS

106.19

106.045236

0.1

21.2

23

0

2

3

6

null

0

1

0

1

0

1

1,16-HEXADECANEDITHIOL

079028-45-8

12,872,692

hexadecane-1,16-dithiol

C(CCCCCCCCS)CCCCCCCS

InChI=1S/C16H34S2/c17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18/h17-18H,1-16H2

JSRUFBZERGYUAT-UHFFFAOYSA-N

C16H34S2

290.6

290.210193

7.6

2

121

0

2

15

18

null

0

1

0

1

0

1

1-BROMODOCOSANE

006938-66-5

81,355

1-bromodocosane

CCCCCCCCCCCCCCCCCCCCCCBr

InChI=1S/C22H45Br/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23/h2-22H2,1H3

QYOXLKAKUAASNA-UHFFFAOYSA-N

C22H45Br

389.5

388.27046

12.5

0

190

0

20

23

null

0

1

0

1

0

1

N-METHYLHYDROXYLAMINE HYDROCHLORIDE

004229-44-1

77,906

N-methylhydroxylamine;hydrochloride

CNO.Cl

InChI=1S/CH5NO.ClH/c1-2-3;/h2-3H,1H3;1H

RGZRSLKIOCHTSI-UHFFFAOYSA-N

CH6ClNO

83.52

83.013792

null

32.3

4

0

3

2

0

4

null

0

1

0

1

0

1

PENICILLAMINE

000052-67-5

5,852

(2S)-2-amino-3-methyl-3-sulfanylbutanoic acid

CC(C)([C@H](C(=O)O)N)S

InChI=1S/C5H11NO2S/c1-5(2,9)3(6)4(7)8/h3,9H,6H2,1-2H3,(H,7,8)/t3-/m0/s1

VVNCNSJFMMFHPL-VKHMYHEASA-N

C5H11NO2S

149.21

149.05105

-1.8

64.3

124

0

3

4

2

9

null

0

1

0

1

0

1

DL-ETHIONINE

000067-21-0

6,205

2-amino-4-ethylsulfanylbutanoic acid

CCSCCC(C(=O)O)N

InChI=1S/C6H13NO2S/c1-2-10-4-3-5(7)6(8)9/h5H,2-4,7H2,1H3,(H,8,9)

GGLZPLKKBSSKCX-UHFFFAOYSA-N

C6H13NO2S

163.24

163.0667

-1.5

88.6

108

0

2

4

5

10

null

0

1

0

1

0

1

3,7-DIMETHYL-1-OCTANOL

000106-21-8

7,792

3,7-dimethyloctan-1-ol

CC(C)CCCC(C)CCO

InChI=1S/C10H22O/c1-9(2)5-4-6-10(3)7-8-11/h9-11H,4-8H2,1-3H3

PRNCMAKCNVRZFX-UHFFFAOYSA-N

C10H22O

158.28

158.167065

3.6

20.2

78

0

1

6

11

null

0

1

0

1

0

MALONAMIDE

000108-13-4

7,911

propanediamide

C(C(=O)N)C(=O)N

InChI=1S/C3H6N2O2/c4-2(6)1-3(5)7/h1H2,(H2,4,6)(H2,5,7)

WRIRWRKPLXCTFD-UHFFFAOYSA-N

C3H6N2O2

102.09

102.042927

-1.8

86.2

87

0

2

7

null

0

1

0

1

0

1

Triethylene Glycol Monomethyl Ether

000112-35-6

8,178

2-[2-(2-methoxyethoxy)ethoxy]ethanol

COCCOCCOCCO

InChI=1S/C7H16O4/c1-9-4-5-11-7-6-10-3-2-8/h8H,2-7H2,1H3

JLGLQAWTXXGVEM-UHFFFAOYSA-N

C7H16O4

164.2

164.104859

-1

47.9

67

0

1

4

8

11

greater than 230 °F (USCG, 1999)

246 °C

0

1

0

1

0

ETHANIMIDAMIDE MONOHYDROCHLORIDE

000124-42-5

67,170

ethanimidamide;hydrochloride

CC(=N)N.Cl

InChI=1S/C2H6N2.ClH/c1-2(3)4;/h1H3,(H3,3,4);1H

WCQOBLXWLRDEQA-UHFFFAOYSA-N

C2H7ClN2

94.54

94.029776

null

49.9

31

0

3

1

0

5

null

0

1

0

1

0

1

(Z)-3,7-DIMETHYL-2,6-OCTADIEN-1-OL ACETATE

000141-12-8

1,549,025

[(2Z)-3,7-dimethylocta-2,6-dienyl] acetate

CC(=CCC/C(=C\COC(=O)C)/C)C

InChI=1S/C12H20O2/c1-10(2)6-5-7-11(3)8-9-14-12(4)13/h6,8H,5,7,9H2,1-4H3/b11-8-

HIGQPQRQIQDZMP-FLIBITNWSA-N

C12H20O2

196.29

196.14633

3.5

26.3

233

0

2

6

14

null

0

1

0

1

0

2-METHYL-2-PROPENOIC ACID, HEXYL ESTER

000142-09-6

8,872

hexyl 2-methylprop-2-enoate

CCCCCCOC(=O)C(=C)C

InChI=1S/C10H18O2/c1-4-5-6-7-8-12-10(11)9(2)3/h2,4-8H2,1,3H3

LNCPIMCVTKXXOY-UHFFFAOYSA-N

C10H18O2

170.25

170.13068

4

26.3

150

0

2

7

12

180 °F (NTP, 1992)

153 to 185 °F at 8 mmHg (NTP, 1992)

0

1

0

1

0

1

1-PENTANAMINE, 1,1,2,2,3,3,4,4,5,5,5-UNDECAFLUORO-N,N-BIS(UNDECAFLUOROPENTYL)-1-PENTANAMINE

000338-84-1

67,646

1,1,2,2,3,3,4,4,5,5,5-undecafluoro-N,N-bis(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl)pentan-1-amine

C(C(C(N(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(F)(F)F)(F)F)(F)F

InChI=1S/C15F33N/c16-1(17,4(22,23)10(34,35)36)7(28,29)13(43,44)49(14(45,46)8(30,31)2(18,19)5(24,25)11(37,38)39)15(47,48)9(32,33)3(20,21)6(26,27)12(40,41)42

AQZYBQIAUSKCCS-UHFFFAOYSA-N

C15F33N

821.11

820.950378

11.9

3.2

1,040

0

34

12

49

null

0

1

0

1

0

HENICOSAFLUORO-10-IODODECANE

000423-62-1

67,920

1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-henicosafluoro-10-iododecane

C(C(C(C(C(C(F)(F)I)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F

InChI=1S/C10F21I/c11-1(12,3(15,16)5(19,20)7(23,24)9(27,28)29)2(13,14)4(17,18)6(21,22)8(25,26)10(30,31)32

UDWBMXSQHOHKOI-UHFFFAOYSA-N

C10F21I

645.98

645.87094

8.1

0

698

0

21

8

32

null

0

1

0

1

0

1

BIS(TRIFLUOROMETHYLSULFONYL)METHANE

000428-76-2

67,931

trifluoro(trifluoromethylsulfonylmethylsulfonyl)methane

C(S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F

InChI=1S/C3H2F6O4S2/c4-2(5,6)14(10,11)1-15(12,13)3(7,8)9/h1H2

QBOFWVRRMVGXIG-UHFFFAOYSA-N

C3H2F6O4S2

280.2

279.92987

1.5

85

371

0

10

2

15

null

0

1

0

1

0

1

METHYLSUCCINIC ACID

000498-21-5

10,349

2-methylbutanedioic acid

CC(CC(=O)O)C(=O)O

InChI=1S/C5H8O4/c1-3(5(8)9)2-4(6)7/h3H,2H2,1H3,(H,6,7)(H,8,9)

WXUAQHNMJWJLTG-UHFFFAOYSA-N

C5H8O4

132.11

132.042259

-0.2

74.6

129

0

2

4

3

9

null

Decomposes (NTP, 1992)

0

1

0

1

0

1

3-(METHYLTHIO)-1-PROPANOL

000505-10-2

10,448

3-methylsulfanylpropan-1-ol

CSCCCO

InChI=1S/C4H10OS/c1-6-4-2-3-5/h5H,2-4H2,1H3

CZUGFKJYCPYHHV-UHFFFAOYSA-N

C4H10OS

106.19

106.045236

0.5

45.5

23

0

1

2

3

6

null

89.00 to 90.00 °C. @ 13.00 mm Hg

0

1

0

1

0

1

3-OXO-PENTANEDIOIC ACID

000542-05-2

68,328

3-oxopentanedioic acid

C(C(=O)CC(=O)O)C(=O)O

InChI=1S/C5H6O5/c6-3(1-4(7)8)2-5(9)10/h1-2H2,(H,7,8)(H,9,10)

OXTNCQMOKLOUAM-UHFFFAOYSA-N

C5H6O5

146.1

146.021523

-0.7

91.7

153

0

2

5

4

10

null

0

1

0

1

0

1

1-TRIACONTANOL

000593-50-0

68,972

triacontan-1-ol

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCO

InChI=1S/C30H62O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31/h31H,2-30H2,1H3

REZQBEBOWJAQKS-UHFFFAOYSA-N

C30H62O

438.8

438.480067

14.9

20.2

288

0

1

28

31

null

0

1

0

1

0

1

ETHYLAMMONIUM BROMIDE

000593-55-5

68,974

ethanamine;hydrobromide

CCN.Br

InChI=1S/C2H7N.BrH/c1-2-3;/h2-3H2,1H3;1H

PNZDZRMOBIIQTC-UHFFFAOYSA-N

C2H8BrN

126

124.98401

null

26

2

0

2

1

0

4

null

0

1

0

1

0

3-METHOXY-1,2-PROPANEDIOL

000623-39-2

92,822

3-methoxypropane-1,2-diol

COCC(CO)O

InChI=1S/C4H10O3/c1-7-3-4(6)2-5/h4-6H,2-3H2,1H3

PSJBSUHYCGQTHZ-UHFFFAOYSA-N

C4H10O3

106.12

106.062994

-1.2

49.7

37

0

2

3

7

null

0

1

0

1

0

1

HEXANAMIDE

000628-02-4

12,332

hexanamide

CCCCCC(=O)N

InChI=1S/C6H13NO/c1-2-3-4-5-6(7)8/h2-5H2,1H3,(H2,7,8)

ALBYIUDWACNRRB-UHFFFAOYSA-N

C6H13NO

115.17

115.099714

1.3

43.1

70

0

1

4

8

null

491 °F at 760 mmHg (NTP, 1992)

0

1

0

1

0

1

2-NONANOL

000628-99-9

12,367

nonan-2-ol

CCCCCCCC(C)O

InChI=1S/C9H20O/c1-3-4-5-6-7-8-9(2)10/h9-10H,3-8H2,1-2H3

NGDNVOAEIVQRFH-UHFFFAOYSA-N

C9H20O

144.25

144.151415

3.4

20.2

61

0

1

6

10

null

193.00 to 194.00 °C. @ 760.00 mm Hg

0

1

0

1

0

TRIETHYLAMMONIUM BROMIDE

000636-70-4

2,734,074

N,N-diethylethanamine;hydrobromide

CCN(CC)CC.Br

InChI=1S/C6H15N.BrH/c1-4-7(5-2)6-3;/h4-6H2,1-3H3;1H

NRTLTGGGUQIRRT-UHFFFAOYSA-N

C6H16BrN

182.1

181.04661

null

3.2

25

0

1

3

8

null

0

1

0

1

0

1

6,10-DIMETHYL-5,9-UNDECADIEN-2-ONE

000689-67-8

1,549,778

(5E)-6,10-dimethylundeca-5,9-dien-2-one

CC(=CCC/C(=C/CCC(=O)C)/C)C

InChI=1S/C13H22O/c1-11(2)7-5-8-12(3)9-6-10-13(4)14/h7,9H,5-6,8,10H2,1-4H3/b12-9+

HNZUNIKWNYHEJJ-FMIVXFBMSA-N

C13H22O

194.31

194.167065

3.7

17.1

230

0

1

6

14

null

0

1

0

1

0

DL-NORVALINE

000760-78-1

824

2-aminopentanoic acid

CCCC(C(=O)O)N

InChI=1S/C5H11NO2/c1-2-3-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)

SNDPXSYFESPGGJ-UHFFFAOYSA-N

C5H11NO2

117.15

117.078979

-2.1

63.3

82

0

2

3

8

null

0

1

0

1

0

1

HEPTANOIC ACID, 2-METHYL-

001188-02-9

14,475

2-methylheptanoic acid

CCCCCC(C)C(=O)O

InChI=1S/C8H16O2/c1-3-4-5-6-7(2)8(9)10/h7H,3-6H2,1-2H3,(H,9,10)

NKBWMBRPILTCRD-UHFFFAOYSA-N

C8H16O2

144.21

144.11503

2.9

37.3

99

0

1

2

5

10

null

140.00 °C. @ 30.00 mm Hg

0

1

0

1

0

GLUTARIC ACID, MONOMETHYL ESTER

001501-27-5

73,917

5-methoxy-5-oxopentanoic acid

COC(=O)CCCC(=O)O

InChI=1S/C6H10O4/c1-10-6(9)4-2-3-5(7)8/h2-4H2,1H3,(H,7,8)

IBMRTYCHDPMBFN-UHFFFAOYSA-N

C6H10O4

146.14

146.057909

0.3

63.6

130

0

1

4

5

10

null

0

1

0

1

0

1

TRIETHOXYOXOVANADIUM

001686-22-2

74,312

ethanol;oxovanadium

CCO.CCO.CCO.O=[V]

InChI=1S/3C2H6O.O.V/c3*1-2-3;;/h3*3H,2H2,1H3;;

IDIDIJSLBFQEKY-UHFFFAOYSA-N

C6H18O4V

205.15

205.064467

null

77.8

25

0

3

4

0

11

null

0

1

0

1

0

1

2-METHYL-2-PROPENOIC ACID, 3,3,4,4,5,5,6,6,6-NONAFLUOROHEXYL ESTER

001799-84-4

74,534

3,3,4,4,5,5,6,6,6-nonafluorohexyl 2-methylprop-2-enoate

CC(=C)C(=O)OCCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F

InChI=1S/C10H9F9O2/c1-5(2)6(20)21-4-3-7(11,12)8(13,14)9(15,16)10(17,18)19/h1,3-4H2,2H3

TYNRPOFACABVSI-UHFFFAOYSA-N

C10H9F9O2

332.16

332.045883

4.6

26.3

411

0

11

7

21

null

0

1

0

1

0

1

N5-(IMINO(NITROAMINO)METHYL)-L-ORNITHINE

002149-70-4

440,005

(2S)-2-amino-5-[[amino(nitramido)methylidene]amino]pentanoic acid

C(C[C@@H](C(=O)O)N)CN=C(N)N[N+](=O)[O-]

InChI=1S/C6H13N5O4/c7-4(5(12)13)2-1-3-9-6(8)10-11(14)15/h4H,1-3,7H2,(H,12,13)(H3,8,9,10)/t4-/m0/s1

MRAUNPAHJZDYCK-BYPYZUCNSA-N

C6H13N5O4

219.2

219.096754

-3.6

160

261

0

4

6

15

null

0

1

0

1

0

1

BUTYLHYDROXYOXOSTANNANE

002273-43-0

16,767

butyl-hydroxy-oxotin

CCCC[Sn](=O)O

InChI=1S/C4H9.H2O.O.Sn/c1-3-4-2;;;/h1,3-4H2,2H3;1H2;;/q;;;+1/p-1

WIHMDCQAEONXND-UHFFFAOYSA-M

C4H10O2Sn

208.83

209.970282

null

37.3

62

0

1

2

3

7

null

1

0

1

0

1

0

Acetylglutamine

002490-97-3

182,230

(2S)-2-acetamido-5-amino-5-oxopentanoic acid

CC(=O)N[C@@H](CCC(=O)N)C(=O)O

InChI=1S/C7H12N2O4/c1-4(10)9-5(7(12)13)2-3-6(8)11/h5H,2-3H2,1H3,(H2,8,11)(H,9,10)(H,12,13)/t5-/m0/s1

KSMRODHGGIIXDV-YFKPBYRVSA-N

C7H12N2O4

188.18

188.079707

-1.4

109

227

0

3

4

5

13

null

604.00 to 605.00 °C. @ 760.00 mm Hg

0

1

0

1

0

1

2-PROPENOIC ACID, OCTYL ESTER

002499-59-4

17,258

octyl prop-2-enoate

CCCCCCCCOC(=O)C=C

InChI=1S/C11H20O2/c1-3-5-6-7-8-9-10-13-11(12)4-2/h4H,2-3,5-10H2,1H3

ANISOHQJBAQUQP-UHFFFAOYSA-N

C11H20O2

184.27

184.14633

4

26.3

141

0

2

9

13

null

0

1

0

1

0

1

METHANESULFONOTHIOIC ACID, S-METHYL ESTER

002949-92-0

18,064

methylsulfonylsulfanylmethane

CSS(=O)(=O)C

InChI=1S/C2H6O2S2/c1-5-6(2,3)4/h1-2H3

XYONNSVDNIRXKZ-UHFFFAOYSA-N

C2H6O2S2

126.2

125.980922

0

67.8

106

0

3

1

6

null

266.00 to 267.00 °C. @ 760.00 mm Hg

0

1

0

1

0

1

ETHENESULFONIC ACID, SODIUM SALT

003039-83-6

3,270,262

sodium ethenesulfonate

C=CS(=O)(=O)[O-].[Na+]

InChI=1S/C2H4O3S.Na/c1-2-6(3,4)5;/h2H,1H2,(H,3,4,5);/q;+1/p-1

BWYYYTVSBPRQCN-UHFFFAOYSA-M

C2H3NaO3S

130.1

129.970059

null

65.6

130

0

3

1

7

null

0

1

0

1

0

1

1-IODODODECANE

004292-19-7

20,282

1-iodododecane

CCCCCCCCCCCCI

InChI=1S/C12H25I/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2-12H2,1H3

GCDPERPXPREHJF-UHFFFAOYSA-N

C12H25I

296.23

296.1001

7.4

0

81

0

10

13

null

0

1

0

1

0

1

2-METHYLPROPENOIC ACID 2-BROMOETHYL ESTER

004513-56-8

78,271

2-bromoethyl 2-methylprop-2-enoate

CC(=C)C(=O)OCCBr

InChI=1S/C6H9BrO2/c1-5(2)6(8)9-4-3-7/h1,3-4H2,2H3

AOUSBQVEVZBMNI-UHFFFAOYSA-N

C6H9BrO2

193.04

191.97859

1.9

26.3

120

0

2

4

9

null

0

1

0

1

0

1

CARBONOHYDRAZONIC DIHYDRAZIDE, MONOHYDROCHLORIDE

005329-29-3

79,235

1,2,3-triaminoguanidine;hydrochloride

C(=NN)(NN)NN.Cl

InChI=1S/CH8N6.ClH/c2-5-1(6-3)7-4;/h2-4H2,(H2,5,6,7);1H

OJUDFURAIYFYBP-UHFFFAOYSA-N

CH9ClN6

140.58

140.057722

null

114

58

0

6

4

2

8

null

0

1

0

1

0

1,4-DIBROMO-2,3-BUTANEDIONE

006305-43-7

22,747

1,4-dibromobutane-2,3-dione

C(C(=O)C(=O)CBr)Br

InChI=1S/C4H4Br2O2/c5-1-3(7)4(8)2-6/h1-2H2

RZMOICJDRADLCT-UHFFFAOYSA-N

C4H4Br2O2

243.88

243.85576

1.2

34.1

96

0

2

3

8

null

0

1

0

1

0

1

2-METHOXYETHYL METHACRYLATE

006976-93-8

81,466

2-methoxyethyl 2-methylprop-2-enoate

CC(=C)C(=O)OCCOC

InChI=1S/C7H12O3/c1-6(2)7(8)10-5-4-9-3/h1,4-5H2,2-3H3

YXYJVFYWCLAXHO-UHFFFAOYSA-N

C7H12O3

144.17

144.078644

1

35.5

129

0

3

5

10

null

0

1

0

1

0

1

0

1

DL-ARGININE

007200-25-1

232

2-amino-5-(diaminomethylideneamino)pentanoic acid

C(CC(C(=O)O)N)CN=C(N)N

InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)

ODKSFYDXXFIFQN-UHFFFAOYSA-N

C6H14N4O2

174.2

174.111676

-4.2

128

176

0

4

5

12

null

0

1

0

1

0

1

Sodium Acrylate

007446-81-3

4,068,533

sodium prop-2-enoate

C=CC(=O)[O-].[Na+]

InChI=1S/C3H4O2.Na/c1-2-3(4)5;/h2H,1H2,(H,4,5);/q;+1/p-1

NNMHYFLPFNGQFZ-UHFFFAOYSA-M

C3H3NaO2

94.04

94.003074

null

40.1

59

0

2

1

6

null

1

0

1

0

1

0

PLATINUM DIIODIDE

007790-39-8

82,252

platinum(2+) diiodide

[I-].[I-].[Pt+2]

InChI=1S/2HI.Pt/h2*1H;/q;;+2/p-2

ZXDJCKVQKCNWEI-UHFFFAOYSA-L

I2Pt

448.89

448.77374

null

0

2

0

3

null

0

1

0

1

0

1

2-PROPYLHEPTAN-1-OL

010042-59-8

24,847

2-propylheptan-1-ol

CCCCCC(CCC)CO

InChI=1S/C10H22O/c1-3-5-6-8-10(9-11)7-4-2/h10-11H,3-9H2,1-2H3

YLQLIQIAXYRMDL-UHFFFAOYSA-N

C10H22O

158.28

158.167065

3.8

20.2

71

0

1

7

11

null

0

1

0

1

0

MAGNESIUM IODIDE

010377-58-9

66,322

magnesium diiodide

[Mg+2].[I-].[I-]

InChI=1S/2HI.Mg/h2*1H;/q;;+2/p-2

BLQJIBCZHWBKSL-UHFFFAOYSA-L

I2Mg

278.114

277.79399

null

0

2

0

2

0

3

null

0

1

0

1

0

HAFNIUM BORIDE (HFB2) Powder

012007-23-7

6,336,857

null

[B].[B].[Hf]

InChI=1S/2B.Hf

LRTTZMZPZHBOPO-UHFFFAOYSA-N

B2Hf

200.11

201.96517

null

0

3

null

0

1

0

1

0

1

NIOBIUM SODIUM OXIDE (NBNAO3)

012034-09-2

4,682,396

sodium oxido(dioxo)niobium

[O-][Nb](=O)=O.[Na+]

InChI=1S/Na.Nb.3O/q+1;;;;-1

UYLYBEXRJGPQSH-UHFFFAOYSA-N

NaNbO3

163.894

163.88089

null

57.2

49

0

3

0

5

null

0

1

0

1

0

1

NIOBIUM OXIDE (NBO2)

012034-59-2

82,839

dioxoniobium

O=[Nb]=O

InChI=1S/Nb.2O

HFLAMWCKUFHSAZ-UHFFFAOYSA-N

NbO2

124.905

124.8962

null

34.1

18

0

2

0

3

null

0

1

0

1

0

1

TERBIUM OXIDE (TB2O3)

012036-41-8

159,410

tris(oxygen(2-));bis(terbium(3+))

[O-2].[O-2].[O-2].[Tb+3].[Tb+3]

InChI=1S/3O.2Tb/q3*-2;2*+3

SCRZPWWVSXWCMC-UHFFFAOYSA-N

O3Tb2

365.849

365.83545

null

3

0

3

0

5

null

0

1

0

1

0

1

TANTALUM (IV) SULFIDE

012143-72-5

82,945

bis(sulfanylidene)tantalum

S=[Ta]=S

InChI=1S/2S.Ta

FAWYJKSBSAKOFP-UHFFFAOYSA-N

S2Ta

245.08

244.89214

null

64.2

18

0

2

0

3

null

0

1

0

1

0

1

PENTACOPPER SILICIDE

012159-07-8

6,336,988

null

[Si].[Cu].[Cu].[Cu].[Cu].[Cu]

InChI=1S/5Cu.Si

JUZTWRXHHZRLED-UHFFFAOYSA-N

Cu5Si

345.81

344.6231

null

0

6

null

0

1

0

1

0

1

PALLADIUM BROMIDE (PDBR2)

013444-94-5

83,469

dibromopalladium

Br[Pd]Br

InChI=1S/2BrH.Pd/h2*1H;/q;;+2/p-2

INIOZDBICVTGEO-UHFFFAOYSA-L

Br2Pd

266.23

265.73811

null

0

2

0

3

null

0

1

0

1

0

1

POTASSIUM TETRACHLOROAURATE

013682-61-6

11,337,898

potassium tetrachlorogold(1-)

Cl[Au-](Cl)(Cl)Cl.[K+]

InChI=1S/Au.4ClH.K/h;4*1H;/q+3;;;;;+1/p-4

JMONCQYBAMKVQQ-UHFFFAOYSA-J

AuCl4K

377.9

377.802737

null

0

19

0

1

0

6

null

0

1

0

1

0

1

N-((1,1-DIMETHYLETHOXY)CARBONYL)-L-VALINE

013734-41-3

83,693

(2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid

CC(C)[C@@H](C(=O)O)NC(=O)OC(C)(C)C

InChI=1S/C10H19NO4/c1-6(2)7(8(12)13)11-9(14)15-10(3,4)5/h6-7H,1-5H3,(H,11,14)(H,12,13)/t7-/m0/s1

SZXBQTSZISFIAO-ZETCQYMHSA-N

C10H19NO4

217.26

217.131408

1.5

75.6

242

0

2

4

5

15

null

0

1

0

1

0

1

(2S)-2-HYDROXY-4-METHYL-PENTANOIC ACID

013748-90-8

83,697

(2S)-2-hydroxy-4-methylpentanoic acid

CC(C)C[C@@H](C(=O)O)O

InChI=1S/C6H12O3/c1-4(2)3-5(7)6(8)9/h4-5,7H,3H2,1-2H3,(H,8,9)/t5-/m0/s1

LVRFTAZAXQPQHI-YFKPBYRVSA-N

C6H12O3

132.16

132.078644

0.9

57.5

98

0

2

3

9

null

0

1

0

1

0

LANTHANUM TRIIODIDE

013813-22-4

83,743

triiodolanthanum

I[La](I)I

InChI=1S/3HI.La/h3*1H;/q;;;+3/p-3

KYKBXWMMXCGRBA-UHFFFAOYSA-K

I3La

519.6189

519.6198

null

0

8

0

4

null

0

1

0

1

0

1

DIPOTASSIUM PALLADIUM TETRANITRITE

013844-89-8

18,763,730

dipotassium;palladium;tetranitrite

N(=O)[O-].N(=O)[O-].N(=O)[O-].N(=O)[O-].[K+].[K+].[Pd]

InChI=1S/2K.4HNO2.Pd/c;;4*2-1-3;/h;;4*(H,2,3);/q2*+1;;;;;/p-4

QZDIEKDUJYMSIK-UHFFFAOYSA-J

K2N4O8Pd-2

368.64

367.80251

null

210

59

-2

0

12

0

15

null

0

1

0

1

0

1

TERBIUM BROMIDE (TBBR3)

014456-47-4

84,452

terbium(3+) tribromide

[Br-].[Br-].[Br-].[Tb+3]

InChI=1S/3BrH.Tb/h3*1H;/q;;;+3/p-3

AZNZWHYYEIQIOC-UHFFFAOYSA-K

Br3Tb

398.64

397.67832

null

0

3

0

4

null

0

1

0

1

0

1

DYSPROSIUM BROMIDE (DYBR3)

014456-48-5

84,453

dysprosium(3+) tribromide

[Br-].[Br-].[Br-].[Dy+3]

InChI=1S/3BrH.Dy/h3*1H;/q;;;+3/p-3

GBLDKMKYYYAAKD-UHFFFAOYSA-K

Br3Dy

402.21

402.68214

null

0

3

0

4

null

0

1

0

1

0

1

ISOTRIDECANOL

027458-92-0

33,865

11-methyldodecan-1-ol

CC(C)CCCCCCCCCCO

InChI=1S/C13H28O/c1-13(2)11-9-7-5-3-4-6-8-10-12-14/h13-14H,3-12H2,1-2H3

XUJLWPFSUCHPQL-UHFFFAOYSA-N

C13H28O

200.36

200.214016

5.4

20.2

99

0

1

10

14

null

1

0

1

0

1

0

2-BUTYLOCTANOIC ACID

027610-92-0

33,970

2-butyloctanoic acid

CCCCCCC(CCCC)C(=O)O

InChI=1S/C12H24O2/c1-3-5-7-8-10-11(12(13)14)9-6-4-2/h11H,3-10H2,1-2H3,(H,13,14)

OARDBPIZDHVTCK-UHFFFAOYSA-N

C12H24O2

200.32

200.17763

4.3

37.3

143

0

1

2

9

14

null

0

1

0

1

0

1

4-METHYLNONANOIC ACID

045019-28-1

62,003

4-methylnonanoic acid

CCCCCC(C)CCC(=O)O

InChI=1S/C10H20O2/c1-3-4-5-6-9(2)7-8-10(11)12/h9H,3-8H2,1-2H3,(H,11,12)

WQTZCQIRCYSUBQ-UHFFFAOYSA-N

C10H20O2

172.26

172.14633

3.6

37.3

121

0

1

2

7

12

null

292.00 to 293.00 °C. @ 760.00 mm Hg

0

1

0

1

0

ALPHA.-(1-OXO-2-PROPENYL)-.OMEGA.-HYDROXYPOLY[OXY(METHYL-1,2-ETHANEDIYL)]

050858-51-0

5,748,640

[(2R)-1-hydroxypropan-2-yl] prop-2-enoate

C[C@H](CO)OC(=O)C=C

InChI=1S/C6H10O3/c1-3-6(8)9-5(2)4-7/h3,5,7H,1,4H2,2H3/t5-/m1/s1

UXYMHGCNVRUGNO-RXMQYKEDSA-N

C6H10O3

130.14

130.062994

0.5

46.5

109

0

1

3

4

9

null

0

1

0

1

0

1

10-BROMO-1-DECANOL

053463-68-6

104,507

10-bromodecan-1-ol

C(CCCCCBr)CCCCO

InChI=1S/C10H21BrO/c11-9-7-5-3-1-2-4-6-8-10-12/h12H,1-10H2

LGZMUUBPTDRQQM-UHFFFAOYSA-N

C10H21BrO

237.18

236.07758

4.4

20.2

76

0

1

9

12

null

0

1

0

1

0

1

DIETHOXYMETHYLOCTADECYLSILANE

067859-75-0

105,838

diethoxy-methyl-octadecylsilane

CCCCCCCCCCCCCCCCCC[Si](C)(OCC)OCC

InChI=1S/C23H50O2Si/c1-5-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26(4,24-6-2)25-7-3/h5-23H2,1-4H3

DJVQMRRXRRBRIH-UHFFFAOYSA-N

C23H50O2Si

386.7

386.358007

null

18.5

265

0

2

21

26

null

0

1

0

1

0

1

2-HYDROXY-3-((2-HYDROXY-1,1-BIS(HYDROXYMETHYL)ETHYL)AMINO)PROPANESULPHONIC ACID

068399-81-5

109,334

3-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino]-2-hydroxypropane-1-sulfonic acid

C(C(CS(=O)(=O)O)O)NC(CO)(CO)CO

InChI=1S/C7H17NO7S/c9-3-7(4-10,5-11)8-1-6(12)2-16(13,14)15/h6,8-12H,1-5H2,(H,13,14,15)

RZQXOGQSPBYUKH-UHFFFAOYSA-N

C7H17NO7S

259.28

259.072573

-6.4

156

273

0

6

8

16

null

0

1

0

1

0

1

METHOXYDIMETHYLOCTADECYLSILANE

071808-65-6

172,903

methoxy-dimethyl-octadecylsilane

CCCCCCCCCCCCCCCCCC[Si](C)(C)OC

InChI=1S/C21H46OSi/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23(3,4)22-2/h5-21H2,1-4H3

RUFRLNPHRPYBLF-UHFFFAOYSA-N

C21H46OSi

342.7

342.331793

null

9.2

228

0

1

18

23

null

0

1

0

1

0

1

(3-BROMOPROPYL)TRIMETHOXYSILANE

051826-90-5

103,984

3-bromopropyl(trimethoxy)silane

CO[Si](CCCBr)(OC)OC

InChI=1S/C6H15BrO3Si/c1-8-11(9-2,10-3)6-4-5-7/h4-6H2,1-3H3

GLISZRPOUBOZDL-UHFFFAOYSA-N

C6H15BrO3Si

243.17

241.99738

null

27.7

89

0

3

6

11

null

0

1

0

1

0

1

HEXADECYLDIMETHYL(3-SULPHONATOPROPYL)AMMONIUM

002281-11-0

92,176

3-[hexadecyl(dimethyl)azaniumyl]propane-1-sulfonate

CCCCCCCCCCCCCCCC[N+](C)(C)CCCS(=O)(=O)[O-]

InChI=1S/C21H45NO3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22(2,3)20-18-21-26(23,24)25/h4-21H2,1-3H3

TUBRCQBRKJXJEA-UHFFFAOYSA-N

C21H45NO3S

391.7

391.312016

7.2

65.6

389

0

3

18

26

null

0

1

0

1

0

1

DIMETHYL(3-SULPHONATOPROPYL)TETRADECYLAMMONIUM

014933-09-6

84,705

3-[dimethyl(tetradecyl)azaniumyl]propane-1-sulfonate

CCCCCCCCCCCCCC[N+](C)(C)CCCS(=O)(=O)[O-]

InChI=1S/C19H41NO3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-17-20(2,3)18-16-19-24(21,22)23/h4-19H2,1-3H3

BHATUINFZWUDIX-UHFFFAOYSA-N

C19H41NO3S

363.6

363.280715

6.1

65.6

361

0

3

16

24

null

0

1

0

1

0

1

Tetrakis(Acetonitrile)Copper (I) Hexafluorophosphate

064443-05-6

11,068,737

tetrakis(acetonitrile);copper(1+);hexafluorophosphate

CC#N.CC#N.CC#N.CC#N.F[P-](F)(F)(F)(F)F.[Cu+]

InChI=1S/4C2H3N.Cu.F6P/c4*1-2-3;;1-7(2,3,4,5)6/h4*1H3;;/q;;;;+1;-1

GNQXUMGHBSAQBV-UHFFFAOYSA-N

C8H12CuF6N4P

372.72

371.999974

null

95.2

92

0

11

0

20

null

0

1

0

1

0

1

Geranylgeraniol

024034-73-9

5,281,365

(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-ol

CC(=CCC/C(=C/CC/C(=C/CC/C(=C/CO)/C)/C)/C)C

InChI=1S/C20H34O/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-21/h9,11,13,15,21H,6-8,10,12,14,16H2,1-5H3/b18-11+,19-13+,20-15+

OJISWRZIEWCUBN-QIRCYJPOSA-N

C20H34O

290.5

290.260966

6.6

20.2

390

0

1

10

21

null

0

1

0

1

0

1

2-Oxopentanoic Acid

001821-02-9

74,563

2-oxopentanoic acid

CCCC(=O)C(=O)O

InChI=1S/C5H8O3/c1-2-3-4(6)5(7)8/h2-3H2,1H3,(H,7,8)

KDVFRMMRZOCFLS-UHFFFAOYSA-N

C5H8O3

116.11

116.047344

0.5

54.4

106

0

1

3

8

null

0

1

0

1

0

1

2-Oxohexanoic Acid, Sodium Salt

013022-85-0

23,669,158

sodium 2-oxohexanoate

CCCCC(=O)C(=O)[O-].[Na+]

InChI=1S/C6H10O3.Na/c1-2-3-4-5(7)6(8)9;/h2-4H2,1H3,(H,8,9);/q;+1/p-1

WDCARDDLMCHULC-UHFFFAOYSA-M

C6H9NaO3

152.12

152.044938

null

57.2

122

0

3

4

10

null

0

1

0

1

0

1

D-xylo-hexulosonic acid, potassium salt

091446-96-7

23,702,137

potassium (2R,3S,4S)-2,3,4,6-tetrahydroxy-5-oxohexanoate

C(C(=O)[C@H]([C@@H]([C@H](C(=O)[O-])O)O)O)O.[K+]

InChI=1S/C6H10O7.K/c7-1-2(8)3(9)4(10)5(11)6(12)13;/h3-5,7,9-11H,1H2,(H,12,13);/q;+1/p-1/t3-,4+,5-;/m1./s1

GSFHMOMWXNDPMM-YMDUGQBDSA-M

C6H9KO7

232.23

231.998534

null

138

206

0

4

7

5

14

null

0

1

0

1

0

1

Dodecyldimethylethylammonium Bromide

068207-00-1

9,880,197

dodecyl-ethyl-dimethylazanium bromide

CCCCCCCCCCCC[N+](C)(C)CC.[Br-]

InChI=1S/C16H36N.BrH/c1-5-7-8-9-10-11-12-13-14-15-16-17(3,4)6-2;/h5-16H2,1-4H3;1H/q+1;/p-1

FFGSPQDSOUPWGY-UHFFFAOYSA-M

C16H36BrN

322.37

321.20311

null

0

152

0

1

12

18

null

0

1

0

1

0

1

Albizziin

001483-07-4

92,891

(2S)-2-amino-3-(carbamoylamino)propanoic acid

C([C@@H](C(=O)O)N)NC(=O)N

InChI=1S/C4H9N3O3/c5-2(3(8)9)1-7-4(6)10/h2H,1,5H2,(H,8,9)(H3,6,7,10)/t2-/m0/s1

GZYFIMLSHBLMKF-REOHCLBHSA-N

C4H9N3O3

147.13

147.064391

-4.6

118

147

0

4

3

10

null

0

1

0

1

0

1

3-(3,3,3-Trimethyl-1,1-bis((trimethylsilyl)oxy)disiloxanyl)propyl methacrylate

017096-07-0

123,371

3-tris(trimethylsilyloxy)silylpropyl 2-methylprop-2-enoate

CC(=C)C(=O)OCCC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C

InChI=1S/C16H38O5Si4/c1-15(2)16(17)18-13-12-14-25(19-22(3,4)5,20-23(6,7)8)21-24(9,10)11/h1,12-14H2,2-11H3

BESKSSIEODQWBP-UHFFFAOYSA-N

C16H38O5Si4

422.8

422.179631

null

54

420

0

5

12

25

null

0

1

0

1

0

1

Hexyldimethyloctylammonium Bromide

187731-26-6

44,630,344

hexyl-dimethyl-octylazanium bromide

CCCCCCCC[N+](C)(C)CCCCCC.[Br-]

InChI=1S/C16H36N.BrH/c1-5-7-9-11-12-14-16-17(3,4)15-13-10-8-6-2;/h5-16H2,1-4H3;1H/q+1;/p-1

KIEOLZRKTOBVMX-UHFFFAOYSA-M

C16H36BrN

322.37

321.20311

null

0

152

0

1

12

18

null

0

1

0

1

0

3-(Trimethylsilyl)Propionic-2,2,3,3-D4 Acid, Sodium Salt, 98 Atom % D

024493-21-8

23,688,921

sodium 2,2,3,3-tetradeuterio-3-trimethylsilylpropanoate

[2H]C([2H])(C(=O)[O-])C([2H])([2H])[Si](C)(C)C.[Na+]

InChI=1S/C6H14O2Si.Na/c1-9(2,3)5-4-6(7)8;/h4-5H2,1-3H3,(H,7,8);/q;+1/p-1/i4D2,5D2;

OIIWPAYIXDCDNL-HGFPCDIYSA-M

C6H13NaO2Si

172.27

172.083358

null

40.1

109

0

2

3

10

null

0

1

0

1

0

1

1-OCTAN-D17-OL

153336-13-1

16,212,925

1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecadeuteriooctan-1-ol

[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])O

InChI=1S/C8H18O/c1-2-3-4-5-6-7-8-9/h9H,2-8H2,1H3/i1D3,2D2,3D2,4D2,5D2,6D2,7D2,8D2

KBPLFHHGFOOTCA-OISRNESJSA-N

C8H18O

147.33

147.24247

3

20.2

43

0

1

6

9

null

0

1

0

1

0

1

GADOLINIUM(III) CARBONATE HYDRATE

038245-36-2

16,212,943

bis(gadolinium(3+));tricarbonate;hydrate

C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].O.[Gd+3].[Gd+3]

InChI=1S/3CH2O3.2Gd.H2O/c3*2-1(3)4;;;/h3*(H2,2,3,4);;;1H2/q;;;2*+3;/p-6

MXYFVHNBWNHETM-UHFFFAOYSA-H

C3H2Gd2O10

512.54

515.81597

null

191

18

0

1

10

0

15

null

0

1

0

1

0

1

5,7-EICOSADIYNOIC ACID

069288-29-5

2,758,733

icosa-5,7-diynoic acid

CCCCCCCCCCCCC#CC#CCCCC(=O)O

InChI=1S/C20H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-12,17-19H2,1H3,(H,21,22)

HFELYOMSJFEHGV-UHFFFAOYSA-N

C20H32O2

304.5

304.24023

7.4

37.3

396

0

1

2

14

22

null

0

1

0

1

0

1

8,10-HENICOSADIYNOIC ACID

174063-95-7

2,759,256

henicosa-8,10-diynoic acid

CCCCCCCCCCC#CC#CCCCCCCC(=O)O

InChI=1S/C21H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23/h2-10,15-20H2,1H3,(H,22,23)

IQQJOZKPAQNXRX-UHFFFAOYSA-N

C21H34O2

318.5

318.25588

7.2

37.3

410

0

1

2

15

23

null

0

1

0

1

0

1

12-MERCAPTODODECANOIC ACID

082001-53-4

566,670

12-sulfanyldodecanoic acid

C(CCCCCC(=O)O)CCCCCS

InChI=1S/C12H24O2S/c13-12(14)10-8-6-4-2-1-3-5-7-9-11-15/h15H,1-11H2,(H,13,14)

SDAWVOFJSUUKMR-UHFFFAOYSA-N

C12H24O2S

232.38

232.149701

4.6

38.3

149

0

2

3

11

15

null

0

1

0

1

0

1

2-HYDROXY-2-METHYLBUTYRIC ACID

003739-30-8

95,433

2-hydroxy-2-methylbutanoic acid

CCC(C)(C(=O)O)O

InChI=1S/C5H10O3/c1-3-5(2,8)4(6)7/h8H,3H2,1-2H3,(H,6,7)

MBIQENSCDNJOIY-UHFFFAOYSA-N

C5H10O3

118.13

118.062994

0.3

57.5

99

0

2

3

2

8

null

0

1

0

1

0

1

SCANDIUM (III) TRIFLATE

144026-79-9

57,451,379

scandium;trifluoromethanesulfonic acid

C(F)(F)(F)S(=O)(=O)O.[Sc]

InChI=1S/CHF3O3S.Sc/c2-1(3,4)8(5,6)7;/h(H,5,6,7);

QUJLPICXDXFRSN-UHFFFAOYSA-N

CHF3O3SSc

195.04

194.915757

null

62.8

158

0

1

6

0

9

null

0

1

0

1

0

1