3,4-Dimethylphenyl isocyanate

CAS Registry Number®

51163-27-0

CAS Name

3,4-Dimethylphenyl isocyanate

Molecular Formula

C9H9NO

Molecular Mass

147.17

Cite this Page

3,4-Dimethylphenyl isocyanate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=51163-27-0 (retrieved 2024-11-22) (CAS RN: 51163-27-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

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

InChIKey

InChIKey=AYCDBMRVKSXYKW-UHFFFAOYSA-N

SMILES

N(=C=O)C1=CC(C)=C(C)C=C1

Canonical SMILES

O=C=NC1=CC=C(C(=C1)C)C

Other Names for this Substance

  • Benzene, 4-isocyanato-1,2-dimethyl-
  • 4-Isocyanato-1,2-dimethylbenzene
  • 3,4-Dimethylphenyl isocyanate
  • 3,4-Xylyl isocyanate
  • 1-Isocyanato-3,4-dimethylbenzene

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