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Substance Name: alpha-Chloro-m-nitrotoluene
RN: 619-23-8
UNII: OJL133898O
InChIKey: APGGSERFJKEWFG-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C7-H6-Cl-N-O2

Molecular Weight

  • 171.582
 
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Names and Synonyms

Name of Substance

  • alpha-Chloro-m-nitrotoluene

Synonyms

  • 1-(Chloromethyl)-3-nitrobenzene
  • 3-Nitrobenzyl chloride
  • alpha-Chloro-m-nitrotoluene
  • Benzene, 1-(chloromethyl)-3-nitro-
  • CCRIS 2324
  • EINECS 210-586-1
  • HSDB 2680
  • m-Nitrobenzyl chloride
  • NSC 9802
  • Toluene, alpha-chloro-3-nitro-
  • Toluene, alpha-chloro-m-nitro-
  • UNII-OJL133898O

Systematic Names

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

Registry Numbers

CAS Registry Number

  • 619-23-8

FDA UNII

  • OJL133898O

System Generated Number

  • 0000619238

Structure Descriptors

InChI

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

InChIKey

APGGSERFJKEWFG-UHFFFAOYSA-N

Smiles

c1(cc(ccc1)CCl)[N+](=O)[O-]

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 46 deg C   EXP
log P (octanol-water) 2.610 (none)   EST
Atmospheric OH Rate Constant 5.31E-13 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.