5-(METHYLTHIO)-2-NITROBENZOIC ACID

Modify Date: 2025-09-11 11:53:59

5-(METHYLTHIO)-2-NITROBENZOIC ACID Structure
5-(METHYLTHIO)-2-NITROBENZOIC ACID structure
Common Name 5-(METHYLTHIO)-2-NITROBENZOIC ACID
CAS Number 68701-32-6 Molecular Weight 213.21000
Density 1.489g/cm3 Boiling Point 407.337ºC at 760 mmHg
Molecular Formula C8H7NO4S Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 5-methylsulfanyl-2-nitrobenzoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.489g/cm3
Boiling Point 407.337ºC at 760 mmHg
Molecular Formula C8H7NO4S
Molecular Weight 213.21000
Exact Mass 213.01000
PSA 108.42000
LogP 2.53810
Index of Refraction 1.642
InChIKey WGHRQILGEUWYCX-UHFFFAOYSA-N
SMILES CSc1ccc([N+](=O)[O-])c(C(=O)O)c1

 Safety Information

HS Code 2930909090

 Synthetic Route

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5-(METHYLTHIO)-2-NITROBENZOIC ACID Structure

5-(METHYLTHIO)-...

CAS#:68701-32-6

Literature: Sircar, Jagadish C.; Capiris, Thomas; Kesten, Stephen J. Journal of Heterocyclic Chemistry, 1981 , vol. 18, p. 117 - 121

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5-(METHYLTHIO)-2-NITROBENZOIC ACID Structure

5-(METHYLTHIO)-...

CAS#:68701-32-6

Literature: Ajinomoto Co., Inc. Patent: US2005/222141 A1, 2005 ; Location in patent: Page/Page column 32 ;

 Customs

HS Code 2930909090
Summary 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

 Synonyms

5-methylthio-2-nitrobenzoic acid
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