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Substance Name: Benzo(c)chrysene
RN: 194-69-4
UNII: 0I8Z8V58Z4
InChIKey: YZWGEMSQAMDWEM-UHFFFAOYSA-N

Classification Code

  • Tumor Data

Molecular Formula

  • C22-H14

Molecular Weight

  • 278.353
 
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Names and Synonyms

Name of Substance

  • Benzo(c)chrysene

Synonyms

  • 1,2,5,6-Dibenzphenanthrene
  • 1,2:5,6-Dibenzophenanthrene
  • 4-05-00-02725 (Beilstein Handbook Reference)
  • Benzo(c)chrysene
  • BRN 1876196
  • CCRIS 6761
  • HSDB 4032
  • UNII-0I8Z8V58Z4

Systematic Name

  • Benzo(c)chrysene

Registry Numbers

CAS Registry Number

  • 194-69-4

FDA UNII

  • 0I8Z8V58Z4

System Generated Number

  • 0000194694

Structure Descriptors

InChI

1S/C22H14/c1-3-7-18-15(5-1)11-14-21-20(18)13-12-17-10-9-16-6-2-4-8-19(16)22(17)21/h1-14H

InChIKey

YZWGEMSQAMDWEM-UHFFFAOYSA-N

Smiles

c12c3c(c4c(cccc4)cc3)ccc2ccc2c1cccc2

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 7.11 (none)   EXP
Water Solubility 1.08E-03 mg/L 25 EST
Vapor Pressure 3.73E-09 mm Hg 25 EST
Henry's Law Constant 4.89E-07 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 5.00E-11 cm3/molecule-sec 25 EST

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