Structure Information
Structure

Compound Identification

SMILES

O=C(N=C=S)C1CCCCC1

InChIKey

InChIKey=WSAOMDFBTKKMJA-UHFFFAOYSA-N

Formula

C8H11NOS

Mass

169.24

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organosulfur compounds

Class

Isothiocyanates

Subclass

Isothiocyanate acids

Intermediate Tree Nodes

Not available

Direct Parent

Isothiocyanate acids

Alternative Parents

Molecular Framework

Aliphatic homomonocyclic compounds

Substituents

Isothiocyanate acid - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aliphatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as isothiocyanate acids. These are acidic derivatives of isothiocyanates with the general formula RC(=O)N=C=S.

External Descriptors

Not available

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