
Organosulfur Compounds
















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4,6-Bis(difluoromethoxy)-2-(methylthio)pyrimidine 98.0+%, TCI America™
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CAS: 100478-25-9 Molecular Formula: C7H6F4N2O2S Molecular Weight (g/mol): 258.191 InChI Key: HURDQHYOXAOOJJ-UHFFFAOYSA-N PubChem CID: 11043427 IUPAC Name: 4,6-bis(difluoromethoxy)-2-methylsulfanylpyrimidine SMILES: CSC1=NC(=CC(=N1)OC(F)F)OC(F)F
PubChem CID | 11043427 |
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CAS | 100478-25-9 |
Molecular Weight (g/mol) | 258.191 |
SMILES | CSC1=NC(=CC(=N1)OC(F)F)OC(F)F |
IUPAC Name | 4,6-bis(difluoromethoxy)-2-methylsulfanylpyrimidine |
InChI Key | HURDQHYOXAOOJJ-UHFFFAOYSA-N |
Molecular Formula | C7H6F4N2O2S |
Methyl Propyl Sulfide 98.0+%, TCI America™
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CAS: 3877-15-4 Molecular Formula: C4H10S Molecular Weight (g/mol): 90.18 MDL Number: MFCD00015219 InChI Key: ZOASGOXWEHUTKZ-UHFFFAOYSA-N Synonym: methyl propyl sulfide,propane, 1-methylthio,sulfide, methyl propyl,methyl propyl sulphide,unii-nxa8rq27b3,1-methylthio propane,1-methylthio-propane,n-propylmethylsulfide,nxa8rq27b3,methyl n-propyl sulfide PubChem CID: 19754 IUPAC Name: 1-(methylsulfanyl)propane SMILES: CCCSC
PubChem CID | 19754 |
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CAS | 3877-15-4 |
Molecular Weight (g/mol) | 90.18 |
MDL Number | MFCD00015219 |
SMILES | CCCSC |
Synonym | methyl propyl sulfide,propane, 1-methylthio,sulfide, methyl propyl,methyl propyl sulphide,unii-nxa8rq27b3,1-methylthio propane,1-methylthio-propane,n-propylmethylsulfide,nxa8rq27b3,methyl n-propyl sulfide |
IUPAC Name | 1-(methylsulfanyl)propane |
InChI Key | ZOASGOXWEHUTKZ-UHFFFAOYSA-N |
Molecular Formula | C4H10S |
Methyl 3-[(2-Methoxy-2-oxoethyl)thio]propionate 98.0+%, TCI America™
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CAS: 7400-45-5 Molecular Formula: C7H12O4S Molecular Weight (g/mol): 192.229 MDL Number: MFCD00043633 InChI Key: XNDKLLFGXIEGKL-UHFFFAOYSA-N Synonym: dimethyl 3-thiaadipate,methyl 3-2-methoxy-2-oxoethyl thio propionate,methyl 3-2-methoxy-2-oxoethyl sulfanyl propanoate,methyl 3-methoxycarbonylmethylthio propionate,methyl 3-2-methoxy-2-oxoethyl thio propanoate,propanoic acid, 3-2-methoxy-2-oxoethyl thio-, methyl ester,propanoic acid, 3-carbomethoxymethylthio-, methyl ester,methyl 3-methoxycarbonyl methylthio propanoate,methyl 3-methoxycarbonyl methylthio propionate,3-2-methoxy-2-oxoethyl thio propionic acid methyl ester PubChem CID: 81891 IUPAC Name: methyl 3-(2-methoxy-2-oxoethyl)sulfanylpropanoate SMILES: COC(=O)CCSCC(=O)OC
PubChem CID | 81891 |
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CAS | 7400-45-5 |
Molecular Weight (g/mol) | 192.229 |
MDL Number | MFCD00043633 |
SMILES | COC(=O)CCSCC(=O)OC |
Synonym | dimethyl 3-thiaadipate,methyl 3-2-methoxy-2-oxoethyl thio propionate,methyl 3-2-methoxy-2-oxoethyl sulfanyl propanoate,methyl 3-methoxycarbonylmethylthio propionate,methyl 3-2-methoxy-2-oxoethyl thio propanoate,propanoic acid, 3-2-methoxy-2-oxoethyl thio-, methyl ester,propanoic acid, 3-carbomethoxymethylthio-, methyl ester,methyl 3-methoxycarbonyl methylthio propanoate,methyl 3-methoxycarbonyl methylthio propionate,3-2-methoxy-2-oxoethyl thio propionic acid methyl ester |
IUPAC Name | methyl 3-(2-methoxy-2-oxoethyl)sulfanylpropanoate |
InChI Key | XNDKLLFGXIEGKL-UHFFFAOYSA-N |
Molecular Formula | C7H12O4S |
Cyclohexyl Isothiocyanate 98.0+%, TCI America™
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CAS: 1122-82-3 Molecular Formula: C7H11NS Molecular Weight (g/mol): 141.232 MDL Number: MFCD00003841 InChI Key: MZSJGCPBOVTKHR-UHFFFAOYSA-N Synonym: cyclohexyl isothiocyanate,cyclohexane, isothiocyanato,isothiocyanocyclohexane,cyclohexyl-isothiocyanat,isothiocyanic acid, cyclohexyl ester,cyclohexylisothiocyanate,cyclohexyl isothiocyanate, isothiocyanato,cyclohexyl-isothiocyanat german,isothiocyanato-cyclohexane,isothiocyanic acid cyclohexyl ester PubChem CID: 14289 IUPAC Name: isothiocyanatocyclohexane SMILES: C1CCC(CC1)N=C=S
PubChem CID | 14289 |
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CAS | 1122-82-3 |
Molecular Weight (g/mol) | 141.232 |
MDL Number | MFCD00003841 |
SMILES | C1CCC(CC1)N=C=S |
Synonym | cyclohexyl isothiocyanate,cyclohexane, isothiocyanato,isothiocyanocyclohexane,cyclohexyl-isothiocyanat,isothiocyanic acid, cyclohexyl ester,cyclohexylisothiocyanate,cyclohexyl isothiocyanate, isothiocyanato,cyclohexyl-isothiocyanat german,isothiocyanato-cyclohexane,isothiocyanic acid cyclohexyl ester |
IUPAC Name | isothiocyanatocyclohexane |
InChI Key | MZSJGCPBOVTKHR-UHFFFAOYSA-N |
Molecular Formula | C7H11NS |
Ethyl Isothiocyanate 97.0+%, TCI America™
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CAS: 542-85-8 Molecular Formula: C3H5NS Molecular Weight (g/mol): 87.14 MDL Number: MFCD00004820 InChI Key: HBNYJWAFDZLWRS-UHFFFAOYSA-N Synonym: ethyl isothiocyanate,ethane, isothiocyanato,ethyl mustard oil,ethylisothiocyanate,isothiocyanic acid, ethyl ester,unii-3284mj2t8p,ccris 7323,ethylisothio-cyanate,isothiocyanato-ethane PubChem CID: 10966 ChEBI: CHEBI:85098 IUPAC Name: isothiocyanatoethane SMILES: CCN=C=S
PubChem CID | 10966 |
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CAS | 542-85-8 |
Molecular Weight (g/mol) | 87.14 |
ChEBI | CHEBI:85098 |
MDL Number | MFCD00004820 |
SMILES | CCN=C=S |
Synonym | ethyl isothiocyanate,ethane, isothiocyanato,ethyl mustard oil,ethylisothiocyanate,isothiocyanic acid, ethyl ester,unii-3284mj2t8p,ccris 7323,ethylisothio-cyanate,isothiocyanato-ethane |
IUPAC Name | isothiocyanatoethane |
InChI Key | HBNYJWAFDZLWRS-UHFFFAOYSA-N |
Molecular Formula | C3H5NS |
2-(Isobutylthio)ethanol 98.0+%, TCI America™
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CAS: 42779-10-2 Molecular Formula: C6H14OS Molecular Weight (g/mol): 134.237 MDL Number: MFCD00014040 InChI Key: PSCYOFJZGIAXOL-UHFFFAOYSA-N Synonym: 2-Hydroxyethyl Isobutyl Sulfide PubChem CID: 545870 IUPAC Name: 2-(2-methylpropylsulfanyl)ethanol SMILES: CC(C)CSCCO
PubChem CID | 545870 |
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CAS | 42779-10-2 |
Molecular Weight (g/mol) | 134.237 |
MDL Number | MFCD00014040 |
SMILES | CC(C)CSCCO |
Synonym | 2-Hydroxyethyl Isobutyl Sulfide |
IUPAC Name | 2-(2-methylpropylsulfanyl)ethanol |
InChI Key | PSCYOFJZGIAXOL-UHFFFAOYSA-N |
Molecular Formula | C6H14OS |
4-Penten-1-yl Isothiocyanate 95.0+%, TCI America™
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CAS: 18060-79-2 Molecular Formula: C6H9NS Molecular Weight (g/mol): 127.21 MDL Number: MFCD00191527 InChI Key: DBISBKDNOKIADM-UHFFFAOYSA-N Synonym: Isothiocyanic Acid 4-Penten-1-yl Ester PubChem CID: 87436 IUPAC Name: 5-isothiocyanatopent-1-ene SMILES: C=CCCCN=C=S
PubChem CID | 87436 |
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CAS | 18060-79-2 |
Molecular Weight (g/mol) | 127.21 |
MDL Number | MFCD00191527 |
SMILES | C=CCCCN=C=S |
Synonym | Isothiocyanic Acid 4-Penten-1-yl Ester |
IUPAC Name | 5-isothiocyanatopent-1-ene |
InChI Key | DBISBKDNOKIADM-UHFFFAOYSA-N |
Molecular Formula | C6H9NS |
1-Adamantyl Isothiocyanate, TCI America™
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CAS: 4411-26-1 Molecular Formula: C11H15NS Molecular Weight (g/mol): 193.308 MDL Number: MFCD00074736 InChI Key: YPKFLUARLJRPQM-UHFFFAOYSA-N Synonym: 1-adamantyl isothiocyanate,isothiocyanic acid 1-adamantyl ester,1-adamantylisothiocyanate,1-isothiocyanato-adamantane,tricyclo 3.3.1.1'3,7 dec-1-yl isocyanate,tricyclo 3.3.1.13,7 decane, 1-isothiocyanato,adamantanisothiocyanate,3r,5s,7s-1-isothiocyanatoadamantane,1-isothiocyanatotricyclo 3.3.1.1∼3,7∼ decane,tricyclo 3.3.1.1 3,7 decane, 1-isothiocyanato PubChem CID: 107279 IUPAC Name: 1-isothiocyanatoadamantane SMILES: C1C2CC3CC1CC(C2)(C3)N=C=S
PubChem CID | 107279 |
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CAS | 4411-26-1 |
Molecular Weight (g/mol) | 193.308 |
MDL Number | MFCD00074736 |
SMILES | C1C2CC3CC1CC(C2)(C3)N=C=S |
Synonym | 1-adamantyl isothiocyanate,isothiocyanic acid 1-adamantyl ester,1-adamantylisothiocyanate,1-isothiocyanato-adamantane,tricyclo 3.3.1.1'3,7 dec-1-yl isocyanate,tricyclo 3.3.1.13,7 decane, 1-isothiocyanato,adamantanisothiocyanate,3r,5s,7s-1-isothiocyanatoadamantane,1-isothiocyanatotricyclo 3.3.1.1∼3,7∼ decane,tricyclo 3.3.1.1 3,7 decane, 1-isothiocyanato |
IUPAC Name | 1-isothiocyanatoadamantane |
InChI Key | YPKFLUARLJRPQM-UHFFFAOYSA-N |
Molecular Formula | C11H15NS |
o-Tolyl Isothiocyanate 99.0+%, TCI America™
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CAS: 614-69-7 Molecular Formula: C8H7NS Molecular Weight (g/mol): 149.211 MDL Number: MFCD00004802 InChI Key: JYKYYPPZLPVIBY-UHFFFAOYSA-N Synonym: 2-methylphenyl isothiocyanate,o-tolyl isothiocyanate,2-tolyl isothiocyanate,o-tolylisothiocyanate,benzene, 1-isothiocyanato-2-methyl,1-isothiocyanato-2-methyl-benzene,2-methylphenylisothiocyanate,isothiocyanic acid o-tolyl ester,isothiocyanic acid, o-tolyl ester,2-methylbenzenisothiocyanate PubChem CID: 69195 IUPAC Name: 1-isothiocyanato-2-methylbenzene SMILES: CC1=CC=CC=C1N=C=S
PubChem CID | 69195 |
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CAS | 614-69-7 |
Molecular Weight (g/mol) | 149.211 |
MDL Number | MFCD00004802 |
SMILES | CC1=CC=CC=C1N=C=S |
Synonym | 2-methylphenyl isothiocyanate,o-tolyl isothiocyanate,2-tolyl isothiocyanate,o-tolylisothiocyanate,benzene, 1-isothiocyanato-2-methyl,1-isothiocyanato-2-methyl-benzene,2-methylphenylisothiocyanate,isothiocyanic acid o-tolyl ester,isothiocyanic acid, o-tolyl ester,2-methylbenzenisothiocyanate |
IUPAC Name | 1-isothiocyanato-2-methylbenzene |
InChI Key | JYKYYPPZLPVIBY-UHFFFAOYSA-N |
Molecular Formula | C8H7NS |
2-Mercapto-4(3H)-quinazolinone 98.0+%, TCI America™
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CAS: 13906-09-7 Molecular Formula: C8H6N2OS Molecular Weight (g/mol): 178.209 MDL Number: MFCD00006885 InChI Key: PUPFOFVEHDNUJU-UHFFFAOYSA-N Synonym: 2-Thio-4(3H)-quinazolinone PubChem CID: 683940 IUPAC Name: 2-sulfanylidene-1H-quinazolin-4-one SMILES: C1=CC=C2C(=C1)C(=O)NC(=S)N2
PubChem CID | 683940 |
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CAS | 13906-09-7 |
Molecular Weight (g/mol) | 178.209 |
MDL Number | MFCD00006885 |
SMILES | C1=CC=C2C(=C1)C(=O)NC(=S)N2 |
Synonym | 2-Thio-4(3H)-quinazolinone |
IUPAC Name | 2-sulfanylidene-1H-quinazolin-4-one |
InChI Key | PUPFOFVEHDNUJU-UHFFFAOYSA-N |
Molecular Formula | C8H6N2OS |
2-(Morpholinothio)benzothiazole 97.0+%, TCI America™
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CAS: 102-77-2 Molecular Formula: C11H12N2OS2 Molecular Weight (g/mol): 252.35 MDL Number: MFCD00022870 InChI Key: MHKLKWCYGIBEQF-UHFFFAOYSA-N Synonym: N-Oxydiethylene-2-benzothiazolesulfenamide PubChem CID: 7619 IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyl)morpholine SMILES: C1COCCN1SC2=NC3=CC=CC=C3S2
PubChem CID | 7619 |
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CAS | 102-77-2 |
Molecular Weight (g/mol) | 252.35 |
MDL Number | MFCD00022870 |
SMILES | C1COCCN1SC2=NC3=CC=CC=C3S2 |
Synonym | N-Oxydiethylene-2-benzothiazolesulfenamide |
IUPAC Name | 4-(1,3-benzothiazol-2-ylsulfanyl)morpholine |
InChI Key | MHKLKWCYGIBEQF-UHFFFAOYSA-N |
Molecular Formula | C11H12N2OS2 |
Methionol 99.0+%, TCI America™
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CAS: 505-10-2 Molecular Formula: C4H10OS Molecular Weight (g/mol): 106.18 MDL Number: MFCD00036560 InChI Key: CZUGFKJYCPYHHV-UHFFFAOYSA-N Synonym: methionol,3-methylthiopropanol,3-methylthio-1-propanol,3-hydroxypropyl methyl sulfide,3-methylthio propanol,3-methylmercapto-1-propanol,1-propanol, 3-methylthio,3-methylsulfanyl propan-1-ol,gamma-methylmercaptopropyl alcohol PubChem CID: 10448 ChEBI: CHEBI:49019 IUPAC Name: 3-(methylsulfanyl)propan-1-ol SMILES: CSCCCO
PubChem CID | 10448 |
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CAS | 505-10-2 |
Molecular Weight (g/mol) | 106.18 |
ChEBI | CHEBI:49019 |
MDL Number | MFCD00036560 |
SMILES | CSCCCO |
Synonym | methionol,3-methylthiopropanol,3-methylthio-1-propanol,3-hydroxypropyl methyl sulfide,3-methylthio propanol,3-methylmercapto-1-propanol,1-propanol, 3-methylthio,3-methylsulfanyl propan-1-ol,gamma-methylmercaptopropyl alcohol |
IUPAC Name | 3-(methylsulfanyl)propan-1-ol |
InChI Key | CZUGFKJYCPYHHV-UHFFFAOYSA-N |
Molecular Formula | C4H10OS |
2-Methyl-3-tetrahydrothiophenone 97.0+%, TCI America™
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CAS: 13679-85-1 Molecular Formula: C5H8OS Molecular Weight (g/mol): 116.178 MDL Number: MFCD00078280 InChI Key: YMZZPMVKABUEBL-UHFFFAOYSA-N Synonym: 2-methyltetrahydrothiophen-3-one,dihydro-2-methyl-3 2h-thiophenone,2-methyldihydrothiophen-3 2h-one,3 2h-thiophenone, dihydro-2-methyl,2-methyltetrahydrothiophene-3-one,2-methyl-3-oxotetrahydrothiophene,2-methyl-4,5-dihydro-3 2h-thiophenone,2-methyl-3-tetrahydrothiophenone,2-methyl tetrahydrothiophen-3-one,xi-dihydro-2-methyl-3 2h-thiophenone PubChem CID: 61664 ChEBI: CHEBI:87506 IUPAC Name: 2-methylthiolan-3-one SMILES: CC1C(=O)CCS1
PubChem CID | 61664 |
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CAS | 13679-85-1 |
Molecular Weight (g/mol) | 116.178 |
ChEBI | CHEBI:87506 |
MDL Number | MFCD00078280 |
SMILES | CC1C(=O)CCS1 |
Synonym | 2-methyltetrahydrothiophen-3-one,dihydro-2-methyl-3 2h-thiophenone,2-methyldihydrothiophen-3 2h-one,3 2h-thiophenone, dihydro-2-methyl,2-methyltetrahydrothiophene-3-one,2-methyl-3-oxotetrahydrothiophene,2-methyl-4,5-dihydro-3 2h-thiophenone,2-methyl-3-tetrahydrothiophenone,2-methyl tetrahydrothiophen-3-one,xi-dihydro-2-methyl-3 2h-thiophenone |
IUPAC Name | 2-methylthiolan-3-one |
InChI Key | YMZZPMVKABUEBL-UHFFFAOYSA-N |
Molecular Formula | C5H8OS |
3-Methylthio-2-butanone 98.0+%, TCI America™
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CAS: 53475-15-3 Molecular Formula: C5H10OS Molecular Weight (g/mol): 118.19 MDL Number: MFCD00008761 InChI Key: HFVLNCDRAMUMCC-UHFFFAOYNA-N Synonym: 3-methylthio-2-butanone,2-butanone, 3-methylthio,3-methylmercapto-2-butanone,3-methylsulfanyl butan-2-one,dl-3-methylthio-2-butanone,dl-3-methylthio butanone,acmc-1auk9,2-butanone,3-methylthio,3-methylsulfanyl-2-butanone PubChem CID: 103788 IUPAC Name: 3-(methylsulfanyl)butan-2-one SMILES: CSC(C)C(C)=O
PubChem CID | 103788 |
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CAS | 53475-15-3 |
Molecular Weight (g/mol) | 118.19 |
MDL Number | MFCD00008761 |
SMILES | CSC(C)C(C)=O |
Synonym | 3-methylthio-2-butanone,2-butanone, 3-methylthio,3-methylmercapto-2-butanone,3-methylsulfanyl butan-2-one,dl-3-methylthio-2-butanone,dl-3-methylthio butanone,acmc-1auk9,2-butanone,3-methylthio,3-methylsulfanyl-2-butanone |
IUPAC Name | 3-(methylsulfanyl)butan-2-one |
InChI Key | HFVLNCDRAMUMCC-UHFFFAOYNA-N |
Molecular Formula | C5H10OS |
Hexadecyl Sulfide 97.0+%, TCI America™
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CAS: 3312-77-4 Molecular Formula: C32H66S Molecular Weight (g/mol): 482.94 MDL Number: MFCD00026657 InChI Key: OILQNNHOQFRDJH-UHFFFAOYSA-N Synonym: Cetyl Sulfide, Dihexadecyl Sulfide PubChem CID: 76823 IUPAC Name: 1-hexadecylsulfanylhexadecane SMILES: CCCCCCCCCCCCCCCCSCCCCCCCCCCCCCCCC
PubChem CID | 76823 |
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CAS | 3312-77-4 |
Molecular Weight (g/mol) | 482.94 |
MDL Number | MFCD00026657 |
SMILES | CCCCCCCCCCCCCCCCSCCCCCCCCCCCCCCCC |
Synonym | Cetyl Sulfide, Dihexadecyl Sulfide |
IUPAC Name | 1-hexadecylsulfanylhexadecane |
InChI Key | OILQNNHOQFRDJH-UHFFFAOYSA-N |
Molecular Formula | C32H66S |