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Substance Name: 1,3-Dibromobenzene
RN: 108-36-1
UNII: 74EF6KH8TC
InChIKey: JSRLURSZEMLAFO-UHFFFAOYSA-N

Molecular Formula

  • C6-H4-Br2

Molecular Weight

  • 235.906
 
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Names and Synonyms

Name of Substance

  • 1,3-Dibromobenzene

Synonyms

  • 1,3-Dibromobenzene
  • EINECS 203-574-2
  • m-Dibromobenzene
  • UNII-74EF6KH8TC

Systematic Names

  • 1,3-Dibromobenzene
  • Benzene, 1,3-dibromo-
  • Benzene, m-dibromo-

Registry Numbers

CAS Registry Number

  • 108-36-1

FDA UNII

  • 74EF6KH8TC

System Generated Number

  • 0000108361

Structure Descriptors

InChI

1S/C6H4Br2/c7-5-2-1-3-6(8)4-5/h1-4H

InChIKey

JSRLURSZEMLAFO-UHFFFAOYSA-N

Smiles

c1c(cccc1Br)Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 900mg/kg (900mg/kg)   Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 44(12), Pg. 19, 1979.
mouse LD50 oral 2250mg/kg (2250mg/kg)   Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 44(12), Pg. 19, 1979.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -7.00E+00 deg C   EXP
Boiling Point 218 deg C   EXP
log P (octanol-water) 3.75 (none)   EXP
Water Solubility 67.5 mg/L 35 EXP
Vapor Pressure 0.269 mm Hg 25 EXP
Henry's Law Constant 1.24E-03 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 7.73E-13 cm3/molecule-sec 25 EST

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