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Substance Name: Dibenzo(a,e)fluoranthene
RN: 5385-75-1
UNII: 8GJV0BR3GN
InChIKey: JHOWUOKQHJHGMU-UHFFFAOYSA-N

Molecular Formula

  • C24-H14

Molecular Weight

  • 302.3746
 

Classification Codes

Classification Codes

  • Mutation Data
  • Tumor Data

Superlist Classification Code

  • Overall Carcinogenic Evaluation: Group 3
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Names and Synonyms

Name of Substance

  • Dibenzo(a,e)fluoranthene

Synonyms

  • 2,3,5,6-Dibenzofluoranthene
  • 4-05-00-02801 (Beilstein Handbook Reference)
  • BRN 2120920
  • CCRIS 6127
  • Dibenzo(a,e)fluoranthene
  • HSDB 6989
  • UNII-8GJV0BR3GN

Systematic Names

  • Dibenz(a,e)aceanthrylene
  • Dibenzo(a,e)fluoranthene

Superlist Names

  • Dibenzo(a,e)fluoranthene
  • Dibenzo(a,e)fluoranthene [Polycyclic aromatic compounds]

Registry Numbers

CAS Registry Number

  • 5385-75-1

FDA UNII

  • 8GJV0BR3GN

System Generated Number

  • 0005385751

Structure Descriptors

InChI

1S/C24H14/c1-3-9-17-15(7-1)13-22-19-11-5-6-12-20(19)23-18-10-4-2-8-16(18)14-21(17)24(22)23/h1-14H

InChIKey

JHOWUOKQHJHGMU-UHFFFAOYSA-N

Smiles

c1ccc2c(c1)c3cc4ccccc4c5cc6ccccc6c2c35

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 232 deg C   EXP
log P (octanol-water) 7.280 (none)   EST
Water Solubility 2.12E-04 mg/L 25 EST
Vapor Pressure 7.33E-11 mm Hg 25 EST
Henry's Law Constant 7.91E-08 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 6.45E-11 cm3/molecule-sec 25 EST

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