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Organosulfur Compounds

Organic compounds that contain one or more sulfur atoms, or sulfur-containing functional groups.
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1

Allyl phenyl sulfide, 97%, Thermo Scientific Chemicals

CAS: 5296-64-0 Molecular Formula: C9H10S Molecular Weight (g/mol): 150.24 MDL Number: MFCD00014957 InChI Key: QGNRLAFFKKBSIM-UHFFFAOYSA-N Synonym: allyl phenyl sulfide,allylthio benzene,allyl phenyl sulfane,benzene, 2-propenylthio,allylphenyl sulfide,phenyl allyl sulfide,allylphenylthioether,allyl phenyl ;sulfane,sulfide, allyl phenyl PubChem CID: 79180 IUPAC Name: prop-2-enylsulfanylbenzene SMILES: C=CCSC1=CC=CC=C1

PubChem CID 79180
CAS 5296-64-0
Molecular Weight (g/mol) 150.24
MDL Number MFCD00014957
SMILES C=CCSC1=CC=CC=C1
Synonym allyl phenyl sulfide,allylthio benzene,allyl phenyl sulfane,benzene, 2-propenylthio,allylphenyl sulfide,phenyl allyl sulfide,allylphenylthioether,allyl phenyl ;sulfane,sulfide, allyl phenyl
IUPAC Name prop-2-enylsulfanylbenzene
InChI Key QGNRLAFFKKBSIM-UHFFFAOYSA-N
Molecular Formula C9H10S
2

Allyl ethyl sulfide, 97%

CAS: 5296-62-8 Molecular Formula: C5H10S Molecular Weight (g/mol): 102.20 MDL Number: MFCD00026979 InChI Key: NOJXPGXFDASWEI-UHFFFAOYSA-N Synonym: allyl ethyl sulfide,4-thia-1-hexene,1-propene-1-one, 3-ethylthio,allylethylsulfide,allyl ethylsulfide,allylethyl sulfide,allyl ethyl sulphide,3-ethylthio-1-propene,acmc-1ao1o PubChem CID: 123229 IUPAC Name: 3-ethylsulfanylprop-1-ene SMILES: CCSCC=C

PubChem CID 123229
CAS 5296-62-8
Molecular Weight (g/mol) 102.20
MDL Number MFCD00026979
SMILES CCSCC=C
Synonym allyl ethyl sulfide,4-thia-1-hexene,1-propene-1-one, 3-ethylthio,allylethylsulfide,allyl ethylsulfide,allylethyl sulfide,allyl ethyl sulphide,3-ethylthio-1-propene,acmc-1ao1o
IUPAC Name 3-ethylsulfanylprop-1-ene
InChI Key NOJXPGXFDASWEI-UHFFFAOYSA-N
Molecular Formula C5H10S
3

Allyl mercaptan, tech., 70%, remainder mainly sulfide, Thermo Scientific Chemicals

CAS: 870-23-5 Molecular Formula: C3H6S Molecular Weight (g/mol): 74.14 MDL Number: MFCD00004894 InChI Key: ULIKDJVNUXNQHS-UHFFFAOYSA-N Synonym: allyl mercaptan,2-propene-1-thiol,allylthiol,allylmercaptan,allyl sulfhydrate,unii-1x587iby09,2-propenyl mercaptan,2-propenyl-1-thiol,ch2=chch2sh,allyl thiol PubChem CID: 13367 IUPAC Name: prop-2-ene-1-thiol SMILES: SCC=C

PubChem CID 13367
CAS 870-23-5
Molecular Weight (g/mol) 74.14
MDL Number MFCD00004894
SMILES SCC=C
Synonym allyl mercaptan,2-propene-1-thiol,allylthiol,allylmercaptan,allyl sulfhydrate,unii-1x587iby09,2-propenyl mercaptan,2-propenyl-1-thiol,ch2=chch2sh,allyl thiol
IUPAC Name prop-2-ene-1-thiol
InChI Key ULIKDJVNUXNQHS-UHFFFAOYSA-N
Molecular Formula C3H6S
4

Allyl methyl sulfide, 98%

CAS: 10152-76-8 Molecular Formula: C4H8S Molecular Weight (g/mol): 88.17 MDL Number: MFCD00008657 InChI Key: NVLPQIPTCCLBEU-UHFFFAOYSA-N Synonym: allyl methyl sulfide,1-propene, 3-methylthio,allyl methyl sulphide,3-methylthio-1-propene,sulfide, allyl methyl,methyl propenyl sulfide,unii-v7qi1r316c,methyl allyl sulfide,ccris 7066 PubChem CID: 66282 IUPAC Name: 3-methylsulfanylprop-1-ene SMILES: CSCC=C

PubChem CID 66282
CAS 10152-76-8
Molecular Weight (g/mol) 88.17
MDL Number MFCD00008657
SMILES CSCC=C
Synonym allyl methyl sulfide,1-propene, 3-methylthio,allyl methyl sulphide,3-methylthio-1-propene,sulfide, allyl methyl,methyl propenyl sulfide,unii-v7qi1r316c,methyl allyl sulfide,ccris 7066
IUPAC Name 3-methylsulfanylprop-1-ene
InChI Key NVLPQIPTCCLBEU-UHFFFAOYSA-N
Molecular Formula C4H8S
5

Diallyl sulfide, 98%

CAS: 592-88-1 Molecular Formula: C6H10S Molecular Weight (g/mol): 114.21 MDL Number: MFCD00008658 InChI Key: UBJVUCKUDDKUJF-UHFFFAOYSA-N Synonym: diallyl sulfide,allyl sulfide,oil garlic,diallylsulfide,thioallyl ether,1-propene, 3,3'-thiobis,allyl monosulfide,diallyl thioether,diallyl monosulfide,diallyl sulphide PubChem CID: 11617 ChEBI: CHEBI:4489 SMILES: C=CCSCC=C

PubChem CID 11617
CAS 592-88-1
Molecular Weight (g/mol) 114.21
ChEBI CHEBI:4489
MDL Number MFCD00008658
SMILES C=CCSCC=C
Synonym diallyl sulfide,allyl sulfide,oil garlic,diallylsulfide,thioallyl ether,1-propene, 3,3'-thiobis,allyl monosulfide,diallyl thioether,diallyl monosulfide,diallyl sulphide
InChI Key UBJVUCKUDDKUJF-UHFFFAOYSA-N
Molecular Formula C6H10S
6

Diallyl disulfide, tech. 80%, remainder mainly diallyl sulfide and diallyl trisulfide

CAS: 2179-57-9 Molecular Formula: C6H10S2 Molecular Weight (g/mol): 146.27 MDL Number: MFCD00008656 InChI Key: PFRGXCVKLLPLIP-UHFFFAOYSA-N Synonym: diallyl disulfide,allyl disulfide,diallyldisulfide,diallyl disulphide,disulfide, di-2-propenyl,1,2-diallyldisulfane,2-propenyl disulphide,allyl disulphide,4,5-dithia-1,7-octadiene,3-allyldisulfanyl-propene PubChem CID: 16590 ChEBI: CHEBI:4488 IUPAC Name: 3-(prop-2-enyldisulfanyl)prop-1-ene SMILES: C=CCSSCC=C

PubChem CID 16590
CAS 2179-57-9
Molecular Weight (g/mol) 146.27
ChEBI CHEBI:4488
MDL Number MFCD00008656
SMILES C=CCSSCC=C
Synonym diallyl disulfide,allyl disulfide,diallyldisulfide,diallyl disulphide,disulfide, di-2-propenyl,1,2-diallyldisulfane,2-propenyl disulphide,allyl disulphide,4,5-dithia-1,7-octadiene,3-allyldisulfanyl-propene
IUPAC Name 3-(prop-2-enyldisulfanyl)prop-1-ene
InChI Key PFRGXCVKLLPLIP-UHFFFAOYSA-N
Molecular Formula C6H10S2
7

3,3'-Dithiodipropionic acid, 98%

CAS: 1119-62-6 Molecular Formula: C6H10O4S2 Molecular Weight (g/mol): 210.26 MDL Number: MFCD00002780 InChI Key: YCLSOMLVSHPPFV-UHFFFAOYSA-N Synonym: 3,3'-dithiodipropionic acid,dithiodipropionic acid,propanoic acid, 3,3'-dithiobis,3,3-dithiodipropionic acid,3,3'-dithiobis dipropionic acid,unii-42op5b2ni6,3,3'-dithiobispropionic acid,propionic acid, 3,3'-dithiodi,3,3'-disulfanediyldipropanoic acid,3-2-carboxyethyl disulfanyl propanoic acid PubChem CID: 95116 IUPAC Name: 3-(2-carboxyethyldisulfanyl)propanoic acid SMILES: C(CSSCCC(=O)O)C(=O)O

PubChem CID 95116
CAS 1119-62-6
Molecular Weight (g/mol) 210.26
MDL Number MFCD00002780
SMILES C(CSSCCC(=O)O)C(=O)O
Synonym 3,3'-dithiodipropionic acid,dithiodipropionic acid,propanoic acid, 3,3'-dithiobis,3,3-dithiodipropionic acid,3,3'-dithiobis dipropionic acid,unii-42op5b2ni6,3,3'-dithiobispropionic acid,propionic acid, 3,3'-dithiodi,3,3'-disulfanediyldipropanoic acid,3-2-carboxyethyl disulfanyl propanoic acid
IUPAC Name 3-(2-carboxyethyldisulfanyl)propanoic acid
InChI Key YCLSOMLVSHPPFV-UHFFFAOYSA-N
Molecular Formula C6H10O4S2
8

2-(Methyldithio)isobutyraldehyde, 95%

CAS: 67952-60-7 Molecular Formula: C5H10OS2 Molecular Weight (g/mol): 150.25 InChI Key: VLBWEJJOETYCSE-UHFFFAOYSA-N Synonym: 2-methyldithio isobutyraldehyde,2-methyl-2-methyldithio propanal,unii-3d5g4az6l5,propanal, 2-methyl-2-methyldithio,2-methyldithio-isobutyraldehyde,alpha-methyldithio isobutyraldehyde,2-methyl-2-methyldisulfanyl propanal,2-methyl-2-methyldithio propionaldehyde,2-methyldisulfanyl isobutyraldehyde,cocoa propanal PubChem CID: 106217 IUPAC Name: 2-methyl-2-(methyldisulfanyl)propanal SMILES: CC(C)(C=O)SSC

PubChem CID 106217
CAS 67952-60-7
Molecular Weight (g/mol) 150.25
SMILES CC(C)(C=O)SSC
Synonym 2-methyldithio isobutyraldehyde,2-methyl-2-methyldithio propanal,unii-3d5g4az6l5,propanal, 2-methyl-2-methyldithio,2-methyldithio-isobutyraldehyde,alpha-methyldithio isobutyraldehyde,2-methyl-2-methyldisulfanyl propanal,2-methyl-2-methyldithio propionaldehyde,2-methyldisulfanyl isobutyraldehyde,cocoa propanal
IUPAC Name 2-methyl-2-(methyldisulfanyl)propanal
InChI Key VLBWEJJOETYCSE-UHFFFAOYSA-N
Molecular Formula C5H10OS2
9

Bis(2-hydroxyethyl) disulfide, tech. 90%

CAS: 1892-29-1 Molecular Formula: C4H10O2S2 Molecular Weight (g/mol): 154.24 MDL Number: MFCD00002906 InChI Key: KYNFOMQIXZUKRK-UHFFFAOYSA-N Synonym: 2-hydroxyethyl disulfide,2,2'-dithiodiethanol,bis 2-hydroxyethyl disulfide,ethanol, 2,2'-dithiobis,hydroxyethyl disulfide,diethanol disulfide,2,2'-dithiobisethanol,2-hydroxyethanedisulfide,usaf th-9,2,2'-disulfanediyldiethanol PubChem CID: 15906 ChEBI: CHEBI:43136 IUPAC Name: 2-(2-hydroxyethyldisulfanyl)ethanol SMILES: OCCSSCCO

PubChem CID 15906
CAS 1892-29-1
Molecular Weight (g/mol) 154.24
ChEBI CHEBI:43136
MDL Number MFCD00002906
SMILES OCCSSCCO
Synonym 2-hydroxyethyl disulfide,2,2'-dithiodiethanol,bis 2-hydroxyethyl disulfide,ethanol, 2,2'-dithiobis,hydroxyethyl disulfide,diethanol disulfide,2,2'-dithiobisethanol,2-hydroxyethanedisulfide,usaf th-9,2,2'-disulfanediyldiethanol
IUPAC Name 2-(2-hydroxyethyldisulfanyl)ethanol
InChI Key KYNFOMQIXZUKRK-UHFFFAOYSA-N
Molecular Formula C4H10O2S2
10

Dibenzyl disulfide, 98+%

CAS: 150-60-7 Molecular Formula: C14H14S2 Molecular Weight (g/mol): 246.386 MDL Number: MFCD00004783 InChI Key: GVPWHKZIJBODOX-UHFFFAOYSA-N Synonym: dibenzyl disulfide,benzyl disulfide,disulfide, bis phenylmethyl,benzyl bisulfide,1,2-dibenzyldisulfane,dibenzyl disulphide,dibenzyldisulfid,bis phenylmethyl disulfide,di phenylmethyl disulfide,disulfide, dibenzyl PubChem CID: 9012 ChEBI: CHEBI:72752 IUPAC Name: (benzyldisulfanyl)methylbenzene SMILES: C1=CC=C(C=C1)CSSCC2=CC=CC=C2

PubChem CID 9012
CAS 150-60-7
Molecular Weight (g/mol) 246.386
ChEBI CHEBI:72752
MDL Number MFCD00004783
SMILES C1=CC=C(C=C1)CSSCC2=CC=CC=C2
Synonym dibenzyl disulfide,benzyl disulfide,disulfide, bis phenylmethyl,benzyl bisulfide,1,2-dibenzyldisulfane,dibenzyl disulphide,dibenzyldisulfid,bis phenylmethyl disulfide,di phenylmethyl disulfide,disulfide, dibenzyl
IUPAC Name (benzyldisulfanyl)methylbenzene
InChI Key GVPWHKZIJBODOX-UHFFFAOYSA-N
Molecular Formula C14H14S2
11

Dimethyl cyanodithioiminocarbonate, 95%

CAS: 10191-60-3 Molecular Formula: C4H6N2S2 Molecular Weight (g/mol): 146.226 MDL Number: MFCD00009825 InChI Key: IULFXBLVJIPESI-UHFFFAOYSA-N Synonym: dimethyl cyanocarbonimidodithioate,dimethyl cyanodithioiminocarbonate,dimethyl n-cyanodithioiminocarbonate,carbonimidodithioic acid, cyano-, dimethyl ester,s,s-dimethyl cyanoimidodithiocarbonate,cyanoimino bis methylthio methane,dimethyl n-cyanoimidodithiocarbonate,dimethyl cyanimidodithiocarbonate,dimethyl cyanoiminodithiocarbonate,dimethyl n-cyanodithiocarbonimidate PubChem CID: 66289 IUPAC Name: bis(methylsulfanyl)methylidenecyanamide SMILES: CSC(=NC#N)SC

PubChem CID 66289
CAS 10191-60-3
Molecular Weight (g/mol) 146.226
MDL Number MFCD00009825
SMILES CSC(=NC#N)SC
Synonym dimethyl cyanocarbonimidodithioate,dimethyl cyanodithioiminocarbonate,dimethyl n-cyanodithioiminocarbonate,carbonimidodithioic acid, cyano-, dimethyl ester,s,s-dimethyl cyanoimidodithiocarbonate,cyanoimino bis methylthio methane,dimethyl n-cyanoimidodithiocarbonate,dimethyl cyanimidodithiocarbonate,dimethyl cyanoiminodithiocarbonate,dimethyl n-cyanodithiocarbonimidate
IUPAC Name bis(methylsulfanyl)methylidenecyanamide
InChI Key IULFXBLVJIPESI-UHFFFAOYSA-N
Molecular Formula C4H6N2S2
12

Cystamine Dihydrochloride, 97%

CAS: 56-17-7 Molecular Formula: C4H12N2S2·2HCl Molecular Weight (g/mol): 225.2 MDL Number: MFCD00012905 InChI Key: YUFRRMZSSPQMOS-UHFFFAOYSA-N Synonym: cystamine dihydrochloride,cystamin dihydrochloride,ethanamine, 2,2'-dithiobis-, dihydrochloride,usaf cb-34,2,2'-disulfanediyldiethanamine dihydrochloride,2-aminoethyl disulfide dihydrochloride,bis 2-aminoethyl disulfide dihydrochloride,cystamine 2hcl,2,2'-dithiodi ethylammonium dichloride,decarboxycystine dihydrochloride PubChem CID: 5941 IUPAC Name: 2-(2-aminoethyldisulfanyl)ethanamine;dihydrochloride SMILES: C(CSSCCN)N.Cl.Cl

PubChem CID 5941
CAS 56-17-7
Molecular Weight (g/mol) 225.2
MDL Number MFCD00012905
SMILES C(CSSCCN)N.Cl.Cl
Synonym cystamine dihydrochloride,cystamin dihydrochloride,ethanamine, 2,2'-dithiobis-, dihydrochloride,usaf cb-34,2,2'-disulfanediyldiethanamine dihydrochloride,2-aminoethyl disulfide dihydrochloride,bis 2-aminoethyl disulfide dihydrochloride,cystamine 2hcl,2,2'-dithiodi ethylammonium dichloride,decarboxycystine dihydrochloride
IUPAC Name 2-(2-aminoethyldisulfanyl)ethanamine;dihydrochloride
InChI Key YUFRRMZSSPQMOS-UHFFFAOYSA-N
Molecular Formula C4H12N2S2·2HCl
13

Tetramethylthiuram monosulfide, 97%

CAS: 97-74-5 Molecular Formula: C6H12N2S3 Molecular Weight (g/mol): 208.356 MDL Number: MFCD00014870 InChI Key: REQPQFUJGGOFQL-UHFFFAOYSA-N Synonym: tetramethylthiuram monosulfide,bis dimethylthiocarbamoyl sulfide,monothiuram,unads,mono-thiurad,tmtm,thiuram mm,aceto tmtm,cyuram ms,ekagom tm PubChem CID: 7347 IUPAC Name: dimethylcarbamothioyl N,N-dimethylcarbamodithioate SMILES: CN(C)C(=S)SC(=S)N(C)C

PubChem CID 7347
CAS 97-74-5
Molecular Weight (g/mol) 208.356
MDL Number MFCD00014870
SMILES CN(C)C(=S)SC(=S)N(C)C
Synonym tetramethylthiuram monosulfide,bis dimethylthiocarbamoyl sulfide,monothiuram,unads,mono-thiurad,tmtm,thiuram mm,aceto tmtm,cyuram ms,ekagom tm
IUPAC Name dimethylcarbamothioyl N,N-dimethylcarbamodithioate
InChI Key REQPQFUJGGOFQL-UHFFFAOYSA-N
Molecular Formula C6H12N2S3
14

Diphenyl disulfide, 98%

CAS: 882-33-7 Molecular Formula: C12H10S2 Molecular Weight (g/mol): 218.332 MDL Number: MFCD00003065 InChI Key: GUUVPOWQJOLRAS-UHFFFAOYSA-N Synonym: diphenyl disulfide,phenyl disulfide,disulfide, diphenyl,diphenyldisulfide,1,2-diphenyldisulfane,phenyldisulfanyl benzene,diphenyl disulphide,biphenyl disulfide,disulfide diphenyl,phenyldithiobenzene PubChem CID: 13436 IUPAC Name: (phenyldisulfanyl)benzene SMILES: C1=CC=C(C=C1)SSC2=CC=CC=C2

PubChem CID 13436
CAS 882-33-7
Molecular Weight (g/mol) 218.332
MDL Number MFCD00003065
SMILES C1=CC=C(C=C1)SSC2=CC=CC=C2
Synonym diphenyl disulfide,phenyl disulfide,disulfide, diphenyl,diphenyldisulfide,1,2-diphenyldisulfane,phenyldisulfanyl benzene,diphenyl disulphide,biphenyl disulfide,disulfide diphenyl,phenyldithiobenzene
IUPAC Name (phenyldisulfanyl)benzene
InChI Key GUUVPOWQJOLRAS-UHFFFAOYSA-N
Molecular Formula C12H10S2
15

Phenyl disulfide, 99%

CAS: 882-33-7 Molecular Formula: C12H10S2 Molecular Weight (g/mol): 218.33 MDL Number: MFCD00003065 InChI Key: GUUVPOWQJOLRAS-UHFFFAOYSA-N Synonym: diphenyl disulfide,phenyl disulfide,disulfide, diphenyl,diphenyldisulfide,1,2-diphenyldisulfane,phenyldisulfanyl benzene,diphenyl disulphide,biphenyl disulfide,disulfide diphenyl,phenyldithiobenzene PubChem CID: 13436 IUPAC Name: (phenyldisulfanyl)benzene SMILES: C1=CC=C(C=C1)SSC2=CC=CC=C2

PubChem CID 13436
CAS 882-33-7
Molecular Weight (g/mol) 218.33
MDL Number MFCD00003065
SMILES C1=CC=C(C=C1)SSC2=CC=CC=C2
Synonym diphenyl disulfide,phenyl disulfide,disulfide, diphenyl,diphenyldisulfide,1,2-diphenyldisulfane,phenyldisulfanyl benzene,diphenyl disulphide,biphenyl disulfide,disulfide diphenyl,phenyldithiobenzene
IUPAC Name (phenyldisulfanyl)benzene
InChI Key GUUVPOWQJOLRAS-UHFFFAOYSA-N
Molecular Formula C12H10S2