2-Nitrophenyl isocyanate

CAS Registry Number®

3320-86-3

CAS Name

2-Nitrophenyl isocyanate

Molecular Formula

C7H4N2O3

Molecular Mass

164.12

Cite this Page

2-Nitrophenyl isocyanate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3320-86-3 (retrieved 2024-11-24) (CAS RN: 3320-86-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    135 °C @ Press: 17 Torr
  • Melting Point (2)

    41 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H4N2O3/c10-5-8-6-3-1-2-4-7(6)9(11)12/h1-4H

InChIKey

InChIKey=JRVZITODZAQRQM-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C=NC=1C=CC=CC1N(=O)=O

Other Names for this Substance

  • Benzene, 1-isocyanato-2-nitro-
  • Isocyanic acid, o-nitrophenyl ester
  • 1-Isocyanato-2-nitrobenzene
  • o-Nitrophenyl isocyanate
  • 2-Nitrophenyl isocyanate

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