Terminology Service for NFDI4Health

2,3-dimethylphenyl isocyanate

Go to external page http://purl.obolibrary.org/obo/CHEBI_63899


An isocyanate that consists of phenyl isocyanate bearing two additional methyl substituents at positions 2 and 3.

Term info

Label

2,3-dimethylphenyl isocyanate

Synonyms
  • 1-isocyanato-2,3-dimethylbenzene
database cross reference
Subsets

3_STAR

IUPAC NAME
1-isocyanato-2,3-dimethylbenzene [ IUPAC ]

charge

0

formula

C9H9NO

has obo namespace

chebi_ontology

has related synonym

2,3-Dimethylphenylisocyanate

id

CHEBI:63899

inchi

InChI=1S/C9H9NO/c1-7-4-3-5-9(8(7)2)10-6-11/h3-5H,1-2H3

inchikey

KNHJIEOCVVIBIV-UHFFFAOYSA-N

mass

147.17390

monoisotopicmass

147.06841

smiles

Cc1cccc(N=C=O)c1C

Term relations

Subclass of: