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Substance Name: 4-Bromobiphenyl
RN: 92-66-0
UNII: OE77OKH5BL
InChIKey: PKJBWOWQJHHAHG-UHFFFAOYSA-N

Classification Codes

  • Mutation Data
  • TSCA Flag S (Substance is Identified in a Final Significant New Use Rule)

Molecular Formula

  • C12-H9-Br

Molecular Weight

  • 233.107
 
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Names and Synonyms

Name of Substance

  • 4-Bromobiphenyl

Synonyms

  • (4-Bromophenyl)benzene
  • 4-Biphenyl bromide
  • 4-Biphenylyl bromide
  • 4-Bromobiphenyl
  • 4-Bromodiphenyl
  • AI3-08855
  • CCRIS 5890
  • EINECS 202-176-6
  • NSC 406933
  • p-Biphenylyl bromide
  • p-Bromobiphenyl
  • p-Bromodiphenyl
  • p-Phenylbromobenzene
  • p-Phenylphenyl bromide
  • UNII-OE77OKH5BL

Systematic Names

  • 1,1'-Biphenyl, 4-bromo-
  • 4-Bromobiphenyl
  • Biphenyl, 4-bromo-

Superlist Names

  • 1,1'-Biphenyl, 4-bromo-
  • 4-Bromodiphenyl

Registry Numbers

CAS Registry Number

  • 92-66-0

FDA UNII

  • OE77OKH5BL

System Generated Number

  • 0000092660

Structure Descriptors

InChI

1S/C12H9Br/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H

InChIKey

PKJBWOWQJHHAHG-UHFFFAOYSA-N

Smiles

c1(c2ccccc2)ccc(Br)cc1

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 91.5 deg C   EXP
Boiling Point 310 deg C   EXP
log P (octanol-water) 4.96 (none)   EXP
Water Solubility 0.653 mg/L 25 EXP
Henry's Law Constant 1.65E-04 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.47E-12 cm3/molecule-sec 25 EST

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