Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Benzene, 1-(bromomethyl)-3-nitro-
RN: 3958-57-4
InChIKey: LNWXALCHPJANMJ-UHFFFAOYSA-N

Molecular Formula

  • C7-H6-Br-N-O2

Molecular Weight

  • 216.033
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • 1-(Bromomethyl)-3-nitrobenzene
  • 2-Nitrobenzyl benzoate
  • 3-Nitrobenzyl bromide
  • alpha-Bromo-m-nitrotoluene
  • CCRIS 7970
  • EINECS 223-557-3
  • m-(Bromomethyl)nitrobenzene
  • m-Nitro-alpha-bromotoluene
  • m-Nitrobenzyl bromide
  • NSC 66499
  • Toluene, alpha-bromo-m-nitro-

Systematic Names

  • alpha-Bromo-3-nitrotoluene
  • Benzene, 1-(bromomethyl)-3-nitro-
  • m-Nitrobenzyl bromide

Registry Numbers

CAS Registry Number

  • 3958-57-4

System Generated Number

  • 0003958574

Structure Descriptors

InChI

1S/C7H6BrNO2/c8-5-6-2-1-3-7(4-6)9(10)11/h1-4H,5H2

InChIKey

LNWXALCHPJANMJ-UHFFFAOYSA-N

Smiles

O=[N+]([O-])c1cccc(CBr)c1

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 59.3 deg C   EXP
log P (octanol-water) 2.700 (none)   EST
Atmospheric OH Rate Constant 4.37E-13 cm3/molecule-sec 25 EST

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