Structure Information
Structure

Compound Identification

SMILES

[Mo++].COC(=O)C1=CC=CC=C1S

InChIKey

InChIKey=AIBWDOGQZXGXCB-UHFFFAOYSA-N

Formula

C8H8MoO2S

Mass

264.16

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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

Direct Parent

O-sulfanylbenzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Benzoate ester - O-sulfanylbenzoic acid or derivatives - Benzoyl - Thiophenol - Methyl ester - Carboxylic acid ester - Carboxylic acid derivative - Organic transition metal salt - Arylthiol - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic cation - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as o-sulfanylbenzoic acids and derivatives. These are benzoic acids (or derivatives) which bear a sulfanyl group (R-SH) attached to the benzene ring at positions 1 and 2, respectively.

External Descriptors

Not available

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