Thiophenols

Organosulfur compounds that consist of a phenyl ring with a thiol functional group substitution; thiol functional groups consist of a sulfur atom bonded to a hydrogen atom (-SH).

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Thiophenol, 99%, AcroSeal™

CAS: 108-98-5 Molecular Formula: C₆H₆S Molecular Weight (g/mol): 110.17 MDL Number: MFCD00004826 InChI Key: RMVRSNDYEFQCLF-UHFFFAOYSA-N Synonym: thiophenol,phenyl mercaptan,mercaptobenzene,phenylthiol,phenylmercaptan,thiofenol,phenol, thio,thiophenate,thiofenol czech,benzene, mercapto PubChem CID: 7969 ChEBI: CHEBI:48498 IUPAC Name: benzenethiol SMILES: C1=CC=C(C=C1)S

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PubChem CID	7969
CAS	108-98-5
Molecular Weight (g/mol)	110.17
ChEBI	CHEBI:48498
MDL Number	MFCD00004826
SMILES	C1=CC=C(C=C1)S
Synonym	thiophenol,phenyl mercaptan,mercaptobenzene,phenylthiol,phenylmercaptan,thiofenol,phenol, thio,thiophenate,thiofenol czech,benzene, mercapto
IUPAC Name	benzenethiol
InChI Key	RMVRSNDYEFQCLF-UHFFFAOYSA-N
Molecular Formula	C₆H₆S

p-Toluenethiol, 98%

CAS: 106-45-6 Molecular Formula: C₇H₈S Molecular Weight (g/mol): 124.2 MDL Number: MFCD00004851 InChI Key: WLHCBQAPPJAULW-UHFFFAOYSA-N Synonym: p-toluenethiol,p-thiocresol,4-thiocresol,4-methylthiophenol,p-methylthiophenol,benzenethiol, 4-methyl,4-toluenethiol,p-tolyl mercaptan,p-thiolcresol,p-tolylthiol PubChem CID: 7811 IUPAC Name: 4-methylbenzenethiol SMILES: CC1=CC=C(C=C1)S

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PubChem CID	7811
CAS	106-45-6
Molecular Weight (g/mol)	124.2
MDL Number	MFCD00004851
SMILES	CC1=CC=C(C=C1)S
Synonym	p-toluenethiol,p-thiocresol,4-thiocresol,4-methylthiophenol,p-methylthiophenol,benzenethiol, 4-methyl,4-toluenethiol,p-tolyl mercaptan,p-thiolcresol,p-tolylthiol
IUPAC Name	4-methylbenzenethiol
InChI Key	WLHCBQAPPJAULW-UHFFFAOYSA-N
Molecular Formula	C₇H₈S

p-Thiocresol, 98%

CAS: 106-45-6 Molecular Formula: C7H8S Molecular Weight (g/mol): 124.201 MDL Number: MFCD00004851 InChI Key: WLHCBQAPPJAULW-UHFFFAOYSA-N Synonym: p-toluenethiol,p-thiocresol,4-thiocresol,4-methylthiophenol,p-methylthiophenol,benzenethiol, 4-methyl,4-toluenethiol,p-tolyl mercaptan,p-thiolcresol,p-tolylthiol PubChem CID: 7811 IUPAC Name: 4-methylbenzenethiol SMILES: CC1=CC=C(C=C1)S

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PubChem CID	7811
CAS	106-45-6
Molecular Weight (g/mol)	124.201
MDL Number	MFCD00004851
SMILES	CC1=CC=C(C=C1)S
Synonym	p-toluenethiol,p-thiocresol,4-thiocresol,4-methylthiophenol,p-methylthiophenol,benzenethiol, 4-methyl,4-toluenethiol,p-tolyl mercaptan,p-thiolcresol,p-tolylthiol
IUPAC Name	4-methylbenzenethiol
InChI Key	WLHCBQAPPJAULW-UHFFFAOYSA-N
Molecular Formula	C7H8S

Thiophenol, 99+%

CAS: 108-98-5 Molecular Formula: C6H6S Molecular Weight (g/mol): 110.174 MDL Number: MFCD00004826 InChI Key: RMVRSNDYEFQCLF-UHFFFAOYSA-N Synonym: thiophenol,phenyl mercaptan,mercaptobenzene,phenylthiol,phenylmercaptan,thiofenol,phenol, thio,thiophenate,thiofenol czech,benzene, mercapto PubChem CID: 7969 ChEBI: CHEBI:48498 IUPAC Name: benzenethiol SMILES: C1=CC=C(C=C1)S

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PubChem CID	7969
CAS	108-98-5
Molecular Weight (g/mol)	110.174
ChEBI	CHEBI:48498
MDL Number	MFCD00004826
SMILES	C1=CC=C(C=C1)S
Synonym	thiophenol,phenyl mercaptan,mercaptobenzene,phenylthiol,phenylmercaptan,thiofenol,phenol, thio,thiophenate,thiofenol czech,benzene, mercapto
IUPAC Name	benzenethiol
InChI Key	RMVRSNDYEFQCLF-UHFFFAOYSA-N
Molecular Formula	C6H6S

Thiophenol, 99%

CAS: 108-98-5 MDL Number: MFCD00004826 InChI Key: RMVRSNDYEFQCLF-UHFFFAOYSA-N Synonym: thiophenol,phenyl mercaptan,mercaptobenzene,phenylthiol,phenylmercaptan,thiofenol,phenol, thio,thiophenate,thiofenol czech,benzene, mercapto PubChem CID: 7969 ChEBI: CHEBI:48498 IUPAC Name: benzenethiol SMILES: C1=CC=C(C=C1)S

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PubChem CID	7969
CAS	108-98-5
ChEBI	CHEBI:48498
MDL Number	MFCD00004826
SMILES	C1=CC=C(C=C1)S
Synonym	thiophenol,phenyl mercaptan,mercaptobenzene,phenylthiol,phenylmercaptan,thiofenol,phenol, thio,thiophenate,thiofenol czech,benzene, mercapto
IUPAC Name	benzenethiol
InChI Key	RMVRSNDYEFQCLF-UHFFFAOYSA-N

4-Mercaptophenol, 98%

CAS: 637-89-8 Molecular Formula: C6H6OS Molecular Weight (g/mol): 126.17 MDL Number: MFCD00004850 InChI Key: BXAVKNRWVKUTLY-UHFFFAOYSA-N Synonym: 4-mercaptophenol,4-hydroxythiophenol,4-hydroxybenzenethiol,p-hydroxythiophenol,phenol, 4-mercapto,p-mercaptophenol,thiohydroquinone,monothiohydroquinone,4-hydroxy thiophenol,hydroquinone, monothio PubChem CID: 240147 IUPAC Name: 4-sulfanylphenol SMILES: OC1=CC=C(S)C=C1

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PubChem CID	240147
CAS	637-89-8
Molecular Weight (g/mol)	126.17
MDL Number	MFCD00004850
SMILES	OC1=CC=C(S)C=C1
Synonym	4-mercaptophenol,4-hydroxythiophenol,4-hydroxybenzenethiol,p-hydroxythiophenol,phenol, 4-mercapto,p-mercaptophenol,thiohydroquinone,monothiohydroquinone,4-hydroxy thiophenol,hydroquinone, monothio
IUPAC Name	4-sulfanylphenol
InChI Key	BXAVKNRWVKUTLY-UHFFFAOYSA-N
Molecular Formula	C6H6OS

3,4-Dimercaptotoluene, 95%

CAS: 496-74-2 Molecular Formula: C₇H₈S₂ Molecular Weight (g/mol): 156.27 MDL Number: MFCD00004844 InChI Key: NIAAGQAEVGMHPM-UHFFFAOYSA-N Synonym: toluene-3,4-dithiol,dithiol,1,2-benzenedithiol, 4-methyl,3,4-dimercaptotoluene,3,4-dimercaptotoluol,1,2-dimercapto-4-methylbenzene,4-methyl-1,2-benzenedithiol,3,4-toluenedithiol,o-toluenesulfonylamide,usaf b-59 PubChem CID: 10334 IUPAC Name: 4-methylbenzene-1,2-dithiol SMILES: CC1=CC(=C(C=C1)S)S

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PubChem CID	10334
CAS	496-74-2
Molecular Weight (g/mol)	156.27
MDL Number	MFCD00004844
SMILES	CC1=CC(=C(C=C1)S)S
Synonym	toluene-3,4-dithiol,dithiol,1,2-benzenedithiol, 4-methyl,3,4-dimercaptotoluene,3,4-dimercaptotoluol,1,2-dimercapto-4-methylbenzene,4-methyl-1,2-benzenedithiol,3,4-toluenedithiol,o-toluenesulfonylamide,usaf b-59
IUPAC Name	4-methylbenzene-1,2-dithiol
InChI Key	NIAAGQAEVGMHPM-UHFFFAOYSA-N
Molecular Formula	C₇H₈S₂

1,3-Benzenedithiol, 95%

CAS: 626-04-0 Molecular Formula: C6H6S2 Molecular Weight (g/mol): 142.23 MDL Number: MFCD00004842 InChI Key: ZWOASCVFHSYHOB-UHFFFAOYSA-N Synonym: 1,3-benzenedithiol,1,3-dimercaptobenzene,dithioresorcin,dithioresorcinol,1,3-benzedithiol,acmc-20ap5g,ksc357g0j PubChem CID: 522062 IUPAC Name: benzene-1,3-dithiol SMILES: SC1=CC(S)=CC=C1

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PubChem CID	522062
CAS	626-04-0
Molecular Weight (g/mol)	142.23
MDL Number	MFCD00004842
SMILES	SC1=CC(S)=CC=C1
Synonym	1,3-benzenedithiol,1,3-dimercaptobenzene,dithioresorcin,dithioresorcinol,1,3-benzedithiol,acmc-20ap5g,ksc357g0j
IUPAC Name	benzene-1,3-dithiol
InChI Key	ZWOASCVFHSYHOB-UHFFFAOYSA-N
Molecular Formula	C6H6S2

2-Naphthalenethiol, 98+%

CAS: 91-60-1 Molecular Formula: C₁₀H₈S Molecular Weight (g/mol): 160.2 MDL Number: MFCD00004086 InChI Key: RFCQDOVPMUSZMN-UHFFFAOYSA-N Synonym: 2-naphthalenethiol,2-mercaptonaphthalene,2-thionaphthol,thionaphthol,2-naphthyl mercaptan,vulcamel tbn,2-naphthyl thiol,renacit 1,rpa no. 2,rpa 2 PubChem CID: 7058 IUPAC Name: naphthalene-2-thiol SMILES: C1=CC=C2C=C(C=CC2=C1)S

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PubChem CID	7058
CAS	91-60-1
Molecular Weight (g/mol)	160.2
MDL Number	MFCD00004086
SMILES	C1=CC=C2C=C(C=CC2=C1)S
Synonym	2-naphthalenethiol,2-mercaptonaphthalene,2-thionaphthol,thionaphthol,2-naphthyl mercaptan,vulcamel tbn,2-naphthyl thiol,renacit 1,rpa no. 2,rpa 2
IUPAC Name	naphthalene-2-thiol
InChI Key	RFCQDOVPMUSZMN-UHFFFAOYSA-N
Molecular Formula	C₁₀H₈S

4-Fluorothiophenol, 97%

CAS: 371-42-6 Molecular Formula: C₆H₅FS Molecular Weight (g/mol): 128.17 MDL Number: MFCD00004846 InChI Key: OKIHXNKYYGUVTE-UHFFFAOYSA-N Synonym: 4-fluorothiophenol,p-fluorothiophenol,4-fluorobenzene-1-thiol,4-fluoro thiophenol,p-fluorophenyl mercaptan,benzenethiol, 4-fluoro,4-fluoro-benzenethiol,4-mercaptofluorobenzene,4-fluorthiophenol,p-fluoro-thiophenol PubChem CID: 67789 IUPAC Name: 4-fluorobenzenethiol SMILES: C1=CC(=CC=C1F)S

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PubChem CID	67789
CAS	371-42-6
Molecular Weight (g/mol)	128.17
MDL Number	MFCD00004846
SMILES	C1=CC(=CC=C1F)S
Synonym	4-fluorothiophenol,p-fluorothiophenol,4-fluorobenzene-1-thiol,4-fluoro thiophenol,p-fluorophenyl mercaptan,benzenethiol, 4-fluoro,4-fluoro-benzenethiol,4-mercaptofluorobenzene,4-fluorthiophenol,p-fluoro-thiophenol
IUPAC Name	4-fluorobenzenethiol
InChI Key	OKIHXNKYYGUVTE-UHFFFAOYSA-N
Molecular Formula	C₆H₅FS

Thioanisole, 99%

CAS: 100-68-5 Molecular Formula: C₇H₈S Molecular Weight (g/mol): 124.21 MDL Number: MFCD00008559 InChI Key: HNKJADCVZUBCPG-UHFFFAOYSA-N Synonym: thioanisole,methyl phenyl sulfide,methylthio benzene,thioanisol,benzene, methylthio,phenylthiomethane,phenyl methyl sulfide,methylsulfanyl benzene,methylphenylsulfide,1-thiaethyl benzene PubChem CID: 7520 IUPAC Name: methylsulfanylbenzene SMILES: CSC1=CC=CC=C1

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PubChem CID	7520
CAS	100-68-5
Molecular Weight (g/mol)	124.21
MDL Number	MFCD00008559
SMILES	CSC1=CC=CC=C1
Synonym	thioanisole,methyl phenyl sulfide,methylthio benzene,thioanisol,benzene, methylthio,phenylthiomethane,phenyl methyl sulfide,methylsulfanyl benzene,methylphenylsulfide,1-thiaethyl benzene
IUPAC Name	methylsulfanylbenzene
InChI Key	HNKJADCVZUBCPG-UHFFFAOYSA-N
Molecular Formula	C₇H₈S

4-Fluorothiophenol, 97%

CAS: 371-42-6 Molecular Formula: C6H5FS Molecular Weight (g/mol): 128.164 MDL Number: MFCD00004846 InChI Key: OKIHXNKYYGUVTE-UHFFFAOYSA-N Synonym: 4-fluorothiophenol,p-fluorothiophenol,4-fluorobenzene-1-thiol,4-fluoro thiophenol,p-fluorophenyl mercaptan,benzenethiol, 4-fluoro,4-fluoro-benzenethiol,4-mercaptofluorobenzene,4-fluorthiophenol,p-fluoro-thiophenol PubChem CID: 67789 IUPAC Name: 4-fluorobenzenethiol SMILES: C1=CC(=CC=C1F)S

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PubChem CID	67789
CAS	371-42-6
Molecular Weight (g/mol)	128.164
MDL Number	MFCD00004846
SMILES	C1=CC(=CC=C1F)S
Synonym	4-fluorothiophenol,p-fluorothiophenol,4-fluorobenzene-1-thiol,4-fluoro thiophenol,p-fluorophenyl mercaptan,benzenethiol, 4-fluoro,4-fluoro-benzenethiol,4-mercaptofluorobenzene,4-fluorthiophenol,p-fluoro-thiophenol
IUPAC Name	4-fluorobenzenethiol
InChI Key	OKIHXNKYYGUVTE-UHFFFAOYSA-N
Molecular Formula	C6H5FS

3-(Methylthio)aniline, 97%

CAS: 1783-81-9 Molecular Formula: C7H9NS Molecular Weight (g/mol): 139.216 MDL Number: MFCD00007793 InChI Key: KCHLDNLIJVSRPK-UHFFFAOYSA-N Synonym: 3-methylthio aniline,3-aminothioanisole,m-aminothioanisole,m-methylthio aniline,benzenamine, 3-methylthio,3-methylmercapto aniline,3-methylsulfanyl aniline,3-methylmercaptoaniline,3-methylthiobenzenamine,m-aminophenyl methyl sulfide PubChem CID: 15693 IUPAC Name: 3-methylsulfanylaniline SMILES: CSC1=CC=CC(=C1)N

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PubChem CID	15693
CAS	1783-81-9
Molecular Weight (g/mol)	139.216
MDL Number	MFCD00007793
SMILES	CSC1=CC=CC(=C1)N
Synonym	3-methylthio aniline,3-aminothioanisole,m-aminothioanisole,m-methylthio aniline,benzenamine, 3-methylthio,3-methylmercapto aniline,3-methylsulfanyl aniline,3-methylmercaptoaniline,3-methylthiobenzenamine,m-aminophenyl methyl sulfide
IUPAC Name	3-methylsulfanylaniline
InChI Key	KCHLDNLIJVSRPK-UHFFFAOYSA-N
Molecular Formula	C7H9NS

3-(Trifluoromethylthio)aniline, 96%

CAS: 369-68-6 Molecular Formula: C7H6F3NS Molecular Weight (g/mol): 193.19 MDL Number: MFCD00190130 InChI Key: DENPAKQJZNDKEL-UHFFFAOYSA-N Synonym: 3-trifluoromethylthio aniline,3-trifluoromethyl sulfanyl aniline,3-aminophenyl trifluoromethyl sulphide,3-aminophenyl trifluoromethyl sulfide,3-trifluoromethyl thio aniline,3-trifluoromethylsulfanyl aniline,benzenamine, 3-trifluoromethyl thio,benzeneamine, 3-trifluoromethyl thio,3-trifluoromethylthio phenylamine PubChem CID: 2735939 IUPAC Name: 3-(trifluoromethylsulfanyl)aniline SMILES: NC1=CC=CC(SC(F)(F)F)=C1

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PubChem CID	2735939
CAS	369-68-6
Molecular Weight (g/mol)	193.19
MDL Number	MFCD00190130
SMILES	NC1=CC=CC(SC(F)(F)F)=C1
Synonym	3-trifluoromethylthio aniline,3-trifluoromethyl sulfanyl aniline,3-aminophenyl trifluoromethyl sulphide,3-aminophenyl trifluoromethyl sulfide,3-trifluoromethyl thio aniline,3-trifluoromethylsulfanyl aniline,benzenamine, 3-trifluoromethyl thio,benzeneamine, 3-trifluoromethyl thio,3-trifluoromethylthio phenylamine
IUPAC Name	3-(trifluoromethylsulfanyl)aniline
InChI Key	DENPAKQJZNDKEL-UHFFFAOYSA-N
Molecular Formula	C7H6F3NS

4-Methoxythiophenol, 97%

CAS: 696-63-9 Molecular Formula: C7H8OS Molecular Weight (g/mol): 140.2 MDL Number: MFCD00004849 InChI Key: NIFAOMSJMGEFTQ-UHFFFAOYSA-N Synonym: 4-methoxythiophenol,p-methoxybenzenethiol,benzenethiol, 4-methoxy,4-methoxybenzene-1-thiol,benzenethiol, p-methoxy,4-mercaptoanisole,4-methoxy thiophenol,4-methoxy-benzenethiol,para-methoxybenzenethiol,4-mercaptoanisol PubChem CID: 12765 IUPAC Name: 4-methoxybenzenethiol SMILES: COC1=CC=C(C=C1)S

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PubChem CID	12765
CAS	696-63-9
Molecular Weight (g/mol)	140.2
MDL Number	MFCD00004849
SMILES	COC1=CC=C(C=C1)S
Synonym	4-methoxythiophenol,p-methoxybenzenethiol,benzenethiol, 4-methoxy,4-methoxybenzene-1-thiol,benzenethiol, p-methoxy,4-mercaptoanisole,4-methoxy thiophenol,4-methoxy-benzenethiol,para-methoxybenzenethiol,4-mercaptoanisol
IUPAC Name	4-methoxybenzenethiol
InChI Key	NIFAOMSJMGEFTQ-UHFFFAOYSA-N
Molecular Formula	C7H8OS

Thiophenols

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