3-Nitrobenzyl chloride

CAS Registry Number®

619-23-8

CAS Name

3-Nitrobenzyl chloride

Molecular Formula

C7H6ClNO2

Molecular Mass

171.58

Cite this Page

3-Nitrobenzyl chloride.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=619-23-8 (retrieved 2024-11-22) (CAS RN: 619-23-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    175-183 °C @ Press: 30-35 Torr

  • Melting Point (1)

    45-47 °C

Source(s)

  • (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)

Other Names and Identifiers

InChI

InChI=1S/C7H6ClNO2/c8-5-6-2-1-3-7(4-6)9(10)11/h1-4H,5H2

InChIKey

InChIKey=APGGSERFJKEWFG-UHFFFAOYSA-N

SMILES

N(=O)(=O)C1=CC(CCl)=CC=C1

Canonical SMILES

O=N(=O)C1=CC=CC(=C1)CCl

Other Names for this Substance

  • Benzene, 1-(chloromethyl)-3-nitro-
  • Toluene, α-chloro-m-nitro-
  • 1-(Chloromethyl)-3-nitrobenzene
  • m-Nitrobenzyl chloride
  • α-Chloro-m-nitrotoluene

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