1-Iodo-3-nitrobenzene

CAS Registry Number®

645-00-1

CAS Name

1-Iodo-3-nitrobenzene

Molecular Formula

C6H4INO2

Molecular Mass

249.01

Cite this Page

1-Iodo-3-nitrobenzene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=645-00-1 (retrieved 2025-03-29) (CAS RN: 645-00-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    161-164 °C @ Press: 24 Torr

  • Melting Point (2)

    38.5 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C6H4INO2/c7-5-2-1-3-6(4-5)8(9)10/h1-4H

InChIKey

InChIKey=CBYAZOKPJYBCHE-UHFFFAOYSA-N

SMILES

N(=O)(=O)C1=CC(I)=CC=C1

Canonical SMILES

O=N(=O)C=1C=CC=C(I)C1

Other Names for this Substance

  • Benzene, 1-iodo-3-nitro-
  • 1-Iodo-3-nitrobenzene
  • m-Iodonitrobenzene
  • 3-Iodonitrobenzene
  • m-Nitrophenyl iodide

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