You are using an unsupported browser. Please upgrade your browser to a newer version to get the best experience on ClassyFire.
Structure Information
Structure

Compound Identification

SMILES

CC1C(C)C(N=C=O)C(C)C(C)C1N=C=O

InChIKey

InChIKey=QKNMFOYJBHCEGR-UHFFFAOYSA-N

Formula

C12H18N2O2

Mass

222.288

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic nitrogen compounds

Class

Organonitrogen compounds

Subclass

Isocyanates

Intermediate Tree Nodes

Not available

Direct Parent

Isocyanates

Alternative Parents

Molecular Framework

Aliphatic homomonocyclic compounds

Substituents

Isocyanate - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as isocyanates. These are organic compounds containing the isocyanic acid tautomer, HN=C=O, of cyanic acid, HOC#N or its hydrocarbyl derivatives RN=C=O.

External Descriptors

Not available

Previous Back Next