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

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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

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4-Mercaptophenylacetic acid, 97%

CAS: 39161-84-7 Molecular Formula: C8H8O2S Molecular Weight (g/mol): 168.21 MDL Number: MFCD00797617 InChI Key: ORXSLDYRYTVAPC-UHFFFAOYSA-N Synonym: 4-mercaptophenylacetic acid,2-4-mercaptophenyl acetic acid,2-4-sulfanylphenyl acetic acid,benzeneacetic acid, 4-mercapto,4-mercapto-phenyl-acetic acid,acmc-20amfq,4-mercaptobenzeneacetate,4-mercapto-phenylacetic acid,4-mercaptophenyl acetic acid,4-mercapto-phenyl acetic acid PubChem CID: 3390511 IUPAC Name: 2-(4-sulfanylphenyl)acetic acid SMILES: OC(=O)CC1=CC=C(S)C=C1

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PubChem CID	3390511
CAS	39161-84-7
Molecular Weight (g/mol)	168.21
MDL Number	MFCD00797617
SMILES	OC(=O)CC1=CC=C(S)C=C1
Synonym	4-mercaptophenylacetic acid,2-4-mercaptophenyl acetic acid,2-4-sulfanylphenyl acetic acid,benzeneacetic acid, 4-mercapto,4-mercapto-phenyl-acetic acid,acmc-20amfq,4-mercaptobenzeneacetate,4-mercapto-phenylacetic acid,4-mercaptophenyl acetic acid,4-mercapto-phenyl acetic acid
IUPAC Name	2-(4-sulfanylphenyl)acetic acid
InChI Key	ORXSLDYRYTVAPC-UHFFFAOYSA-N
Molecular Formula	C8H8O2S

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4-Bromothiophenol, 95%

CAS: 106-53-6 Molecular Formula: C₆H₅BrS Molecular Weight (g/mol): 189.07 MDL Number: MFCD00004845 InChI Key: FTBCOQFMQSTCQQ-UHFFFAOYSA-N Synonym: 4-bromothiophenol,benzenethiol, 4-bromo,p-bromothiophenol,p-bromobenzenethiol,4-bromobenzene-1-thiol,4-bromo-benzenethiol,4-bromo thiophenol,p-bromophenyl thiol,benzenethiol, p-bromo,unii-p3wuo03x17 PubChem CID: 66049 IUPAC Name: 4-bromobenzenethiol SMILES: C1=CC(=CC=C1S)Br

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PubChem CID	66049
CAS	106-53-6
Molecular Weight (g/mol)	189.07
MDL Number	MFCD00004845
SMILES	C1=CC(=CC=C1S)Br
Synonym	4-bromothiophenol,benzenethiol, 4-bromo,p-bromothiophenol,p-bromobenzenethiol,4-bromobenzene-1-thiol,4-bromo-benzenethiol,4-bromo thiophenol,p-bromophenyl thiol,benzenethiol, p-bromo,unii-p3wuo03x17
IUPAC Name	4-bromobenzenethiol
InChI Key	FTBCOQFMQSTCQQ-UHFFFAOYSA-N
Molecular Formula	C₆H₅BrS

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2-(Methylthio)naphthalene, 98%

CAS: 7433-79-6 Molecular Formula: C11H10S Molecular Weight (g/mol): 174.261 MDL Number: MFCD00051615 InChI Key: SSKUUDUKJMIOKQ-UHFFFAOYSA-N Synonym: 2-methylthio naphthalene,2-methylmercaptonaphthalene,2-methylsulfanyl naphthalene,2-methylthionaphthalene,methyl2-naphthylsulfide,methyl 2-naphthyl sulfide,naphth-2-yl methyl thioether,naphthalene,2-methylthio,methyl naphthalen-2-yl sulfane PubChem CID: 139022 IUPAC Name: 2-methylsulfanylnaphthalene SMILES: CSC1=CC2=CC=CC=C2C=C1

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PubChem CID	139022
CAS	7433-79-6
Molecular Weight (g/mol)	174.261
MDL Number	MFCD00051615
SMILES	CSC1=CC2=CC=CC=C2C=C1
Synonym	2-methylthio naphthalene,2-methylmercaptonaphthalene,2-methylsulfanyl naphthalene,2-methylthionaphthalene,methyl2-naphthylsulfide,methyl 2-naphthyl sulfide,naphth-2-yl methyl thioether,naphthalene,2-methylthio,methyl naphthalen-2-yl sulfane
IUPAC Name	2-methylsulfanylnaphthalene
InChI Key	SSKUUDUKJMIOKQ-UHFFFAOYSA-N
Molecular Formula	C11H10S

4-Nitrobenzenethiol 95.0+%, TCI America™

CAS: 1849-36-1 Molecular Formula: C6H5NO2S Molecular Weight (g/mol): 155.171 MDL Number: MFCD00007343 InChI Key: AXBVSRMHOPMXBA-UHFFFAOYSA-N Synonym: 4-nitrothiophenol,4-nitrobenzenethiol,p-nitrothiophenol,benzenethiol, 4-nitro,p-nitrophenyl mercaptan,p-nitrobenzenethiol,benzenethiol, p-nitro,4-nitrobenzene-1-thiol,4-nitrothiophenolate,4-nitro-benzenethiol PubChem CID: 15809 SMILES: C1=CC(=CC=C1[N+](=O)[O-])S

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PubChem CID	15809
CAS	1849-36-1
Molecular Weight (g/mol)	155.171
MDL Number	MFCD00007343
SMILES	C1=CC(=CC=C1[N+](=O)[O-])S
Synonym	4-nitrothiophenol,4-nitrobenzenethiol,p-nitrothiophenol,benzenethiol, 4-nitro,p-nitrophenyl mercaptan,p-nitrobenzenethiol,benzenethiol, p-nitro,4-nitrobenzene-1-thiol,4-nitrothiophenolate,4-nitro-benzenethiol
InChI Key	AXBVSRMHOPMXBA-UHFFFAOYSA-N
Molecular Formula	C6H5NO2S

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PubChem CID	15809
CAS	1849-36-1
Molecular Weight (g/mol)	155.171
MDL Number	MFCD00007343
SMILES	C1=CC(=CC=C1[N+](=O)[O-])S
Synonym	4-nitrothiophenol,4-nitrobenzenethiol,p-nitrothiophenol,benzenethiol, 4-nitro,p-nitrophenyl mercaptan,p-nitrobenzenethiol,benzenethiol, p-nitro,4-nitrobenzene-1-thiol,4-nitrothiophenolate,4-nitro-benzenethiol
InChI Key	AXBVSRMHOPMXBA-UHFFFAOYSA-N
Molecular Formula	C6H5NO2S

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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

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Thioanisole, 99%

CAS: 100-68-5 Molecular Formula: C7H8S Molecular Weight (g/mol): 124.201 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)	124.201
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

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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

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4-Chlorothioanisole, 98%

CAS: 123-09-1 Molecular Formula: C7H7ClS Molecular Weight (g/mol): 158.643 MDL Number: MFCD00013643 InChI Key: KIQQUVJOLVCZKG-UHFFFAOYSA-N Synonym: 4-chlorothioanisole,4-chlorophenyl methyl sulfide,p-chlorothioanisole,1-chloro-4-methylthio benzene,p-chlorophenyl methyl sulfide,methyl 4-chlorophenyl sulfide,benzene, 1-chloro-4-methylthio,p-chlophenyl methyl sulfide,1-chloro-4-methylsulfanyl benzene,4-chloro thioanisole PubChem CID: 31243 IUPAC Name: 1-chloro-4-methylsulfanylbenzene SMILES: CSC1=CC=C(C=C1)Cl

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PubChem CID	31243
CAS	123-09-1
Molecular Weight (g/mol)	158.643
MDL Number	MFCD00013643
SMILES	CSC1=CC=C(C=C1)Cl
Synonym	4-chlorothioanisole,4-chlorophenyl methyl sulfide,p-chlorothioanisole,1-chloro-4-methylthio benzene,p-chlorophenyl methyl sulfide,methyl 4-chlorophenyl sulfide,benzene, 1-chloro-4-methylthio,p-chlophenyl methyl sulfide,1-chloro-4-methylsulfanyl benzene,4-chloro thioanisole
IUPAC Name	1-chloro-4-methylsulfanylbenzene
InChI Key	KIQQUVJOLVCZKG-UHFFFAOYSA-N
Molecular Formula	C7H7ClS

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3-(tert-Butyldimethylsiloxy)thiophenol, 95%, Thermo Scientific Chemicals

CAS: 216393-56-5 Molecular Formula: C12H20OSSi Molecular Weight (g/mol): 240.44 MDL Number: MFCD01318115 InChI Key: KRHCTXFJCFMFOR-UHFFFAOYSA-N Synonym: 3-tert-butyldimethylsilyl oxy benzenethiol,3-tert-butyldimethylsiloxy thiophenol,acmc-20ani3,3-tert-butyl-dimethylsiloxy-thiophenol,3-tert-butyldimethylsilyloxy benzenethiol,3-t-butyl-dimethyl-silanyloxy-benzenethiol,3-tert-butyl-dimethyl-silanyloxy-benzenethiol,3-tert-butyl dimethyl silyl oxy benzene-1-thiol,3-1,1-dimethylethyl dimethyl silyl oxy benzenethiol PubChem CID: 21976868 SMILES: CC(C)(C)[Si](C)(C)OC1=CC(S)=CC=C1

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PubChem CID	21976868
CAS	216393-56-5
Molecular Weight (g/mol)	240.44
MDL Number	MFCD01318115
SMILES	CC(C)(C)[Si](C)(C)OC1=CC(S)=CC=C1
Synonym	3-tert-butyldimethylsilyl oxy benzenethiol,3-tert-butyldimethylsiloxy thiophenol,acmc-20ani3,3-tert-butyl-dimethylsiloxy-thiophenol,3-tert-butyldimethylsilyloxy benzenethiol,3-t-butyl-dimethyl-silanyloxy-benzenethiol,3-tert-butyl-dimethyl-silanyloxy-benzenethiol,3-tert-butyl dimethyl silyl oxy benzene-1-thiol,3-1,1-dimethylethyl dimethyl silyl oxy benzenethiol
InChI Key	KRHCTXFJCFMFOR-UHFFFAOYSA-N
Molecular Formula	C12H20OSSi

5-chloro-2-(methylthio)aniline, 95%, Thermo Scientific™

CAS: 16423-54-4 Molecular Formula: C7H8ClNS Molecular Weight (g/mol): 173.658 MDL Number: MFCD00052816 InChI Key: RWUQNIPYCAHKMO-UHFFFAOYSA-N PubChem CID: 2794577 IUPAC Name: 5-chloro-2-methylsulfanylaniline SMILES: CSC1=C(C=C(C=C1)Cl)N

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PubChem CID	2794577
CAS	16423-54-4
Molecular Weight (g/mol)	173.658
MDL Number	MFCD00052816
SMILES	CSC1=C(C=C(C=C1)Cl)N
IUPAC Name	5-chloro-2-methylsulfanylaniline
InChI Key	RWUQNIPYCAHKMO-UHFFFAOYSA-N
Molecular Formula	C7H8ClNS

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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

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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

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