Terminology Service for NFDI4Health
3,4-dimethylphenyl isocyanate
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http://purl.obolibrary.org/obo/CHEBI_60098
An isocyanate that consists of phenyl isocyanate bearing two additional methyl substituents at positions 3 and 4.
Term info
Label
3,4-dimethylphenyl isocyanate
Synonyms
- 4-isocyanato-1,2-dimethylbenzene
Subsets
3_STAR
charge
0
formula
C9H9NO
has obo namespace
chebi_ontology
has related synonym
3,4-dimethylphenylisocyanate, 3,4-dimethyl phenylisocyanate
id
CHEBI:60098
inchi
InChI=1S/C9H9NO/c1-7-3-4-9(10-6-11)5-8(7)2/h3-5H,1-2H3
inchikey
AYCDBMRVKSXYKW-UHFFFAOYSA-N
mass
147.17390
monoisotopicmass
147.06841
smiles
Cc1ccc(cc1C)N=C=O