Sulfanylbenzoic acids and derivatives

Thiosalicylic acid, 98%, ACROS Organics™

CAS: 147-93-3 Molecular Formula: C7H6O2S Molecular Weight (g/mol): 154.183 MDL Number: MFCD00004836 InChI Key: NBOMNTLFRHMDEZ-UHFFFAOYSA-N Synonym: 2-carboxythiophenol PubChem CID: 5443 ChEBI: CHEBI:59124 IUPAC Name: 2-sulfanylbenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)S

Alfa Aesar™ Thiosalicylic acid, 98%

CAS: 147-93-3 Molecular Formula: C7H6O2S Molecular Weight (g/mol): 154.183 MDL Number: MFCD00004836 InChI Key: NBOMNTLFRHMDEZ-UHFFFAOYSA-N Synonym: 2-carboxythiophenol PubChem CID: 5443 ChEBI: CHEBI:59124 IUPAC Name: 2-sulfanylbenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)S

Alfa Aesar™ 4-(Pentafluorothio)benzoyl chloride, 97%

CAS: 197384-98-8 Molecular Formula: C7H4ClF5OS Molecular Weight (g/mol): 266.61 MDL Number: MFCD03788523 InChI Key: NNFDYUZNKYWPGP-UHFFFAOYSA-N Synonym: 4-chlorocarbonyl phenylsulphur pentafluoride PubChem CID: 2779215 IUPAC Name: 4-(pentafluoro-$l^{6}-sulfanyl)benzoyl chloride SMILES: C1=CC(=CC=C1C(=O)Cl)S(F)(F)(F)(F)F

Alfa Aesar™ 3-(Pentafluorothio)benzoyl chloride, 97%

CAS: 401892-81-7 Molecular Formula: C7H4ClF5OS Molecular Weight (g/mol): 266.61 MDL Number: MFCD03788522 InChI Key: IDHIADOQLRPGHK-UHFFFAOYSA-N Synonym: 3-pentafluoro-$l^ 6-sulfanyl benzoyl chloride PubChem CID: 2779213 IUPAC Name: 3-(pentafluoro-$l^{6}-sulfanyl)benzoyl chloride SMILES: C1=CC(=CC(=C1)S(F)(F)(F)(F)F)C(=O)Cl

Alfa Aesar™ 4-(Trifluoromethylthio)benzoic acid, 97%

CAS: 330-17-6 Molecular Formula: C8H5F3O2S Molecular Weight (g/mol): 222.181 MDL Number: MFCD00040906 InChI Key: UMOGQQWVQUQTQA-UHFFFAOYSA-N Synonym: 4-trifluoromethyl sulfanyl benzoic acid PubChem CID: 2777858 IUPAC Name: 4-(trifluoromethylsulfanyl)benzoic acid SMILES: C1=CC(=CC=C1C(=O)O)SC(F)(F)F

Alfa Aesar™ Thimerosal

CAS: 54-64-8 Molecular Formula: C9H9HgNaO2S Molecular Weight (g/mol): 404.811 MDL Number: MFCD00013062 InChI Key: RTKIYNMVFMVABJ-UHFFFAOYSA-L Synonym: mercurothiolate PubChem CID: 16684434 ChEBI: CHEBI:9546 IUPAC Name: sodium;(2-carboxylatophenyl)sulfanyl-ethylmercury SMILES: CC[Hg]SC1=CC=CC=C1C(=O)[O-].[Na+]

Methyl thiosalicylate, 97%, Acros Organics™

CAS: 4892-02-8 Molecular Formula: C8H8O2S Molecular Weight (g/mol): 168.22 MDL Number: MFCD00060678 InChI Key: BAQGCWNPCFABAY-UHFFFAOYSA-N Synonym: 2-mercaptobenzoic acid methyl ester PubChem CID: 21009 IUPAC Name: methyl 2-sulfanylbenzoate SMILES: COC(=O)C1=CC=CC=C1S

3-(Methylthio)benzoic Acid 98.0+%, TCI America™

CAS: 825-99-0 Molecular Formula: C8H8O2S Molecular Weight (g/mol): 168.21 MDL Number: MFCD00156993 InChI Key: PZGADOOBMVLBJE-UHFFFAOYSA-N Synonym: 3-carboxythioanisole PubChem CID: 220329 IUPAC Name: 3-methylsulfanylbenzoic acid SMILES: CSC1=CC=CC(=C1)C(=O)O

4-Mercaptobenzoic Acid 95.0+%, TCI America™

CAS: 1074-36-8 Molecular Formula: C7H6O2S Molecular Weight (g/mol): 154.183 MDL Number: MFCD00016617 InChI Key: LMJXSOYPAOSIPZ-UHFFFAOYSA-N Synonym: 4-mercapto benzoic acid PubChem CID: 95738 IUPAC Name: 4-sulfanylbenzoic acid SMILES: C1=CC(=CC=C1C(=O)O)S

1,1-Dichlorodimethyl ether, 97%, Acros Organics™

CAS: 4885-02-3 Molecular Formula: C2H4Cl2O Molecular Weight (g/mol): 114.96 MDL Number: MFCD00000828 InChI Key: BAQGCWNPCFABAY-UHFFFAOYSA-N Synonym: 2-mercaptobenzoic acid methyl ester PubChem CID: 21009 IUPAC Name: methyl 2-sulfanylbenzoate SMILES: COC(=O)C1=CC=CC=C1S

Thimerosal, Fisher BioReagents

CAS: 54-64-8 Molecular Formula: C9H9HgNaO2S Molecular Weight (g/mol): 404.811 InChI Key: RTKIYNMVFMVABJ-UHFFFAOYSA-L Synonym: Sodium ethylmercurithiosalicylate PubChem CID: 16684434 ChEBI: CHEBI:9546 IUPAC Name: sodium;(2-carboxylatophenyl)sulfanyl-ethylmercury SMILES: CC[Hg]SC1=CC=CC=C1C(=O)[O-].[Na+]

4-Mercaptobenzoic acid, 90%, ACROS Organics™

CAS: 1074-36-8 Molecular Formula: C7H6O2S Molecular Weight (g/mol): 154.19 MDL Number: MFCD00016617 InChI Key: LMJXSOYPAOSIPZ-UHFFFAOYSA-N Synonym: 4-mercapto benzoic acid PubChem CID: 95738 IUPAC Name: 4-sulfanylbenzoic acid SMILES: C1=CC(=CC=C1C(=O)O)S

Alfa Aesar™ 2-Fluoro-5-(pentafluorothio)benzoic acid, 97%

CAS: 1240257-15-1 Molecular Formula: C7H4F6O2S Molecular Weight (g/mol): 266.157 MDL Number: MFCD16652494 InChI Key: HQONRARZDMQSRY-UHFFFAOYSA-N Synonym: 2-fluoro-5-pentafluoro-??-sulfanyl benzoic acid PubChem CID: 66523626 IUPAC Name: 2-fluoro-5-(pentafluoro-$l^{6}-sulfanyl)benzoic acid SMILES: C1=CC(=C(C=C1S(F)(F)(F)(F)F)C(=O)O)F

Alfa Aesar™ 4-(Methylthio)benzoic acid, 97%

CAS: 13205-48-6 Molecular Formula: C8H8O2S Molecular Weight (g/mol): 168.21 MDL Number: MFCD00002555 InChI Key: KWHCPERWLHBLOT-UHFFFAOYSA-N Synonym: 4-methylsulfanyl benzoic acid PubChem CID: 83230 IUPAC Name: 4-methylsulfanylbenzoic acid SMILES: CSC1=CC=C(C=C1)C(=O)O

Alfa Aesar™ 3-(Trifluoromethylthio)benzoic acid, 97%

CAS: 946-65-6 Molecular Formula: C8H5F3O2S Molecular Weight (g/mol): 222.181 MDL Number: MFCD00236337 InChI Key: IVGAPIVNQABETQ-UHFFFAOYSA-N Synonym: 3-carboxyphenyl trifluoromethyl sulphide PubChem CID: 688330 IUPAC Name: 3-(trifluoromethylsulfanyl)benzoic acid SMILES: C1=CC(=CC(=C1)SC(F)(F)F)C(=O)O

Alfa Aesar™ 2-Methyl-5-(pentafluorothio)benzoic acid, 97%

CAS: 623943-54-4 Molecular Formula: C8H7F5O2S Molecular Weight (g/mol): 262.194 MDL Number: MFCD16652477 InChI Key: HSIPIUUYFOAFKK-UHFFFAOYSA-N Synonym: 2-methyl-5-pentafluoro-??-sulfanyl benzoic acid PubChem CID: 66523588 IUPAC Name: 2-methyl-5-(pentafluoro-$l^{6}-sulfanyl)benzoic acid SMILES: CC1=C(C=C(C=C1)S(F)(F)(F)(F)F)C(=O)O

Alfa Aesar™ 2-(Carboxymethylthio)benzoic acid, 97%

CAS: 135-13-7 Molecular Formula: C9H8O4S Molecular Weight (g/mol): 212.219 MDL Number: MFCD00021761 InChI Key: GMBZSYUPMWCDGK-UHFFFAOYSA-N Synonym: 2-carboxymethyl sulfanyl benzoic acid PubChem CID: 8660 IUPAC Name: 2-(carboxymethylsulfanyl)benzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)SCC(=O)O

4-(Methylthio)benzoic acid, 98%, ACROS Organics™

CAS: 13205-48-6 Molecular Formula: C8H8O2S Molecular Weight (g/mol): 168.21 MDL Number: MFCD00002555 InChI Key: KWHCPERWLHBLOT-UHFFFAOYSA-N Synonym: 4-methylsulfanyl benzoic acid PubChem CID: 83230 IUPAC Name: 4-methylsulfanylbenzoic acid SMILES: CSC1=CC=C(C=C1)C(=O)O

Alfa Aesar™ 3-Fluoro-5-(pentafluorothio)benzoic acid, 97%

CAS: 1448319-13-8 Molecular Formula: C7H4F6O2S Molecular Weight (g/mol): 266.157 MDL Number: MFCD16652421 InChI Key: WQRFQFPUMUJGOL-UHFFFAOYSA-N Synonym: 3-fluoro-5-pentafluoro-??-sulfanyl benzoic acid PubChem CID: 66523461 IUPAC Name: 3-fluoro-5-(pentafluoro-$l^{6}-sulfanyl)benzoic acid SMILES: C1=C(C=C(C=C1F)S(F)(F)(F)(F)F)C(=O)O

Alfa Aesar™ 2-Chloro-5-(pentafluorothio)benzamide, 97%

CAS: 1431329-71-3 Molecular Formula: C7H5ClF5NOS Molecular Weight (g/mol): 281.625 MDL Number: MFCD22988934 InChI Key: ISPQOXNUNOTXHB-UHFFFAOYSA-N Synonym: 2-chloro-5-pentafluoro-??-sulfanyl benzamide PubChem CID: 73995213 IUPAC Name: 2-chloro-5-(pentafluoro-$l^{6}-sulfanyl)benzamide SMILES: C1=CC(=C(C=C1S(F)(F)(F)(F)F)C(=O)N)Cl

Alfa Aesar™ 3-Chloro-5-(pentafluorothio)benzoyl chloride, 97%

CAS: 1240257-81-1 Molecular Formula: C7H3Cl2F5OS Molecular Weight (g/mol): 301.052 MDL Number: MFCD16652451 InChI Key: GLJCAZZLRUQUSD-UHFFFAOYSA-N Synonym: 3-chloro-5-pentafluoro-??-sulfanyl benzoyl chloride PubChem CID: 66523519 IUPAC Name: 3-chloro-5-(pentafluoro-$l^{6}-sulfanyl)benzoyl chloride SMILES: C1=C(C=C(C=C1S(F)(F)(F)(F)F)Cl)C(=O)Cl

Alfa Aesar™ 3-Chloro-5-(pentafluorothio)benzoic acid, 97%

CAS: 1448317-67-6 Molecular Formula: C7H4ClF5O2S Molecular Weight (g/mol): 282.609 MDL Number: MFCD16652415 InChI Key: QEUCPMZEYUIRBW-UHFFFAOYSA-N Synonym: 3-chloro-5-pentafluoro-??-sulfanyl benzoic acid PubChem CID: 66523456 IUPAC Name: 3-chloro-5-(pentafluoro-$l^{6}-sulfanyl)benzoic acid SMILES: C1=C(C=C(C=C1S(F)(F)(F)(F)F)Cl)C(=O)O

Alfa Aesar™ 3-Bromo-5-(pentafluorothio)benzoic acid, 97%

CAS: 1180675-98-2 Molecular Formula: C7H4BrF5O2S Molecular Weight (g/mol): 327.063 MDL Number: MFCD16652482 InChI Key: GGDWTFSLWQRHPR-UHFFFAOYSA-N Synonym: 3-bromo-5-pentafluoro-??-sulfanyl benzoic acid PubChem CID: 58137421 IUPAC Name: 3-bromo-5-(pentafluoro-$l^{6}-sulfanyl)benzoic acid SMILES: C1=C(C=C(C=C1S(F)(F)(F)(F)F)Br)C(=O)O

Alfa Aesar™ 3-(Pentafluorothio)benzoic acid, 97%

CAS: 833-96-5 Molecular Formula: C7H5F5O2S Molecular Weight (g/mol): 248.167 MDL Number: MFCD03788519 InChI Key: AKFDIYXSRGLRAB-UHFFFAOYSA-N Synonym: 3-carboxyphenylsulphur pentafluoride PubChem CID: 2779209 IUPAC Name: 3-(pentafluoro-$l^{6}-sulfanyl)benzoic acid SMILES: C1=CC(=CC(=C1)S(F)(F)(F)(F)F)C(=O)O

Alfa Aesar™ 2-Methoxy-5-(pentafluorothio)benzoic acid, 97%

CAS: 1448319-14-9 Molecular Formula: C8H7F5O3S Molecular Weight (g/mol): 278.193 MDL Number: MFCD16652486 InChI Key: STKWSTMSPXNSCO-UHFFFAOYSA-N Synonym: 2-methoxy-5-pentafluoro-??-sulfanyl benzoic acid PubChem CID: 66523609 IUPAC Name: 2-methoxy-5-(pentafluoro-$l^{6}-sulfanyl)benzoic acid SMILES: COC1=C(C=C(C=C1)S(F)(F)(F)(F)F)C(=O)O

Alfa Aesar™ Methyl thiosalicylate, 97%

CAS: 4892-02-8 Molecular Formula: C8H8O2S Molecular Weight (g/mol): 168.21 MDL Number: MFCD00060678 InChI Key: BAQGCWNPCFABAY-UHFFFAOYSA-N Synonym: 2-mercaptobenzoic acid methyl ester PubChem CID: 21009 IUPAC Name: methyl 2-sulfanylbenzoate SMILES: COC(=O)C1=CC=CC=C1S

Ethylmercurithiosalicylic acid, sodium salt, 97.0-101.0%, ACROS Organics™

CAS: 54-64-8 Molecular Formula: C9H9HgNaO2S Molecular Weight (g/mol): 404.811 MDL Number: MFCD00013062 InChI Key: RTKIYNMVFMVABJ-UHFFFAOYSA-L Synonym: mercurothiolate PubChem CID: 16684434 ChEBI: CHEBI:9546 IUPAC Name: sodium;(2-carboxylatophenyl)sulfanyl-ethylmercury SMILES: CC[Hg]SC1=CC=CC=C1C(=O)[O-].[Na+]

Alfa Aesar™ 3-(Pentafluorothio)benzamide, 97%

CAS: 1240257-83-3 Molecular Formula: C7H6F5NOS Molecular Weight (g/mol): 247.183 MDL Number: MFCD16652410 InChI Key: YLMGGQIZDXTBKX-UHFFFAOYSA-N Synonym: 3-pentafluoro-??-sulfanyl benzamide PubChem CID: 66523450 IUPAC Name: 3-(pentafluoro-$l^{6}-sulfanyl)benzamide SMILES: C1=CC(=CC(=C1)S(F)(F)(F)(F)F)C(=O)N

Alfa Aesar™ 2-(Methylsulfinyl)benzoic acid, 97%

CAS: 19093-34-6 Molecular Formula: C8H8O3S Molecular Weight (g/mol): 184.209 MDL Number: MFCD01936003 InChI Key: JVYFTEBQXOBPAB-UHFFFAOYSA-N Synonym: 2-methanesulfinyl benzoic acid PubChem CID: 320058 IUPAC Name: 2-methylsulfinylbenzoic acid SMILES: CS(=O)C1=CC=CC=C1C(=O)O

Alfa Aesar™ 3-(Methylthio)benzoic acid, 97%

CAS: 825-99-0 Molecular Formula: C8H8O2S Molecular Weight (g/mol): 168.21 MDL Number: MFCD00156993 InChI Key: PZGADOOBMVLBJE-UHFFFAOYSA-N Synonym: 3-carboxythioanisole PubChem CID: 220329 IUPAC Name: 3-methylsulfanylbenzoic acid SMILES: CSC1=CC=CC(=C1)C(=O)O

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