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p-Tolyl Isocyanate-[d7]

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General Information
Catalog: BLP-003926
CAS: 1219798-59-0
Molecular Formula: CD3C6D4NCO
Molecular Weight: 140.19

Chemical Structure

Synonyms	p-Tolyl-d7 Isocyanate
IUPAC Name	1,2,4,5-tetradeuterio-3-isocyanato-6-(trideuteriomethyl)benzene
Related CAS	622-58-2 (unlabelled)
Canonical SMILES	CC1=CC=C(C=C1)N=C=O
InChI	InChI=1S/C8H7NO/c1-7-2-4-8(5-3-7)9-6-10/h2-5H,1H3/i1D3,2D,3D,4D,5D
InChI Key	MGYGFNQQGAQEON-AAYPNNLASA-N
Boiling Point	190.6±19.0°C at 760 mmHg
Density	1.0±0.1 g/cm3