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Substance Name: Benzo(j)fluoranthene
RN: 205-82-3
UNII: P63HLW88W8
InChIKey: KHNYNFUTFKJLDD-UHFFFAOYSA-N

Note

  • Dihydrodiol metabolites identified as mutagens.

Molecular Formula

  • C20-H12

Molecular Weight

  • 252.315
 

Classification Codes

Classification Codes

  • Mutation Data
  • Tumor Data

Superlist Classification Codes

  • Overall Carcinogenic Evaluation: Group 2B
  • Reasonably Anticipated to be a Carcinogen
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Names and Synonyms

Name of Substance

  • Benzo(j)fluoranthene

Synonyms

  • 10,11-Benzfluoranthene
  • 10,11-Benzofluoranthene
  • 4-05-00-02687 (Beilstein Handbook Reference)
  • 7,8-Benzofluoranthene
  • B(j)F
  • Benz(j)fluoranthene
  • Benzo(j)fluoranthene
  • Benzo(l)fluoranthene
  • Benzo-12,13-fluoranthene
  • BRN 2049099
  • CCRIS 73
  • Dibenzo(a,jk)fluorene
  • EINECS 205-910-3
  • HSDB 4034
  • UNII-P63HLW88W8

Systematic Name

  • Benzo(j)fluoranthene

Superlist Names

  • Benzo(j)fluoranthene
  • Benzo(j)fluoranthene [Polycyclic aromatic compounds]
  • Benzo(j)fluoranthene [Polycyclic aromatic hydrocarbons]

Registry Numbers

CAS Registry Number

  • 205-82-3

FDA UNII

  • P63HLW88W8

System Generated Number

  • 0000205823

Structure Descriptors

InChI

1S/C20H12/c1-2-8-15-13(5-1)11-12-17-16-9-3-6-14-7-4-10-18(19(14)16)20(15)17/h1-12H

InChIKey

KHNYNFUTFKJLDD-UHFFFAOYSA-N

Smiles

c12c(c3cccc4c3c1ccc4)ccc1c2cccc1

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 166 deg C   EXP
log P (octanol-water) 6.110 (none)   EST
Water Solubility 0.0025 mg/L   EXP
Vapor Pressure 2.62E-08 mm Hg 25 EST
Henry's Law Constant 2.03E-07 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 5.36E-11 cm3/molecule-sec 25 EST

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