Structure Information
Structure

Compound Identification

SMILES

CC(C)SC1=CC=CC(=C1)C(O)=O

InChIKey

InChIKey=OPAFGGLXKOKGCI-UHFFFAOYSA-N

Formula

C10H12O2S

Mass

196.26

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Sulfanylbenzoic acids and derivatives - M-sulfanylbenzoic acids and derivatives

Direct Parent

M-sulfanylbenzoic acids

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

M-sulfanylbenzoic acid - Benzoic acid - Aryl thioether - Benzoyl - Thiophenol ether - Alkylarylthioether - Carboxylic acid derivative - Carboxylic acid - Thioether - Sulfenyl compound - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as m-sulfanylbenzoic acids. These are benzoic acids which bear a sulfanyl group (R-SH) attached to the benzene ring at positions 1 and 3, respectively.

External Descriptors

Not available

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