Benzoyl isocyanate

CAS Registry Number®

4461-33-0

CAS Name

Benzoyl isocyanate

Molecular Formula

C8H5NO2

Molecular Mass

147.13

Cite this Page

Benzoyl isocyanate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4461-33-0 (retrieved 2024-11-29) (CAS RN: 4461-33-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    82-84 °C @ Press: 10 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H5NO2/c10-6-9-8(11)7-4-2-1-3-5-7/h1-5H

InChIKey

InChIKey=LURYMYITPCOQAU-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C=NC(=O)C=1C=CC=CC1

Other Names for this Substance

  • Benzoyl isocyanate
  • Benzoic acid, anhydride with isocyanic acid
  • Benzoic acid, anhydride with HNCO
  • Isocyanic acid, anhydride with benzoic acid
  • NSC 246191

CAS INSIGHTSTM
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