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Chrysene-5,6-oxide

  • Name Chrysene-5,6-oxide
  • EINECSN/A
  • CAS No. 15131-84-7
  • Density1.285g/cm3
  • PSA12.53000
  • LogP4.63280
  • SolubilityN/A
  • Melting PointN/A
  • FormulaC18H12 O
  • Boiling Point447.3°Cat760mmHg
  • Molecular Weight244.293
  • Flash Point212.4°C
  • Transport InformationN/A
  • AppearanceN/A
  • SafetyQuestionable carcinogen with experimental tumorigenic data. Mutation data reported. When heated to decomposition it emits acrid smoke and fumes. See also CHRYSENE.
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 15131-84-7 (chrysene-5,6-oxide)
  • Hazard SymbolsN/A
  • SynonymsN/A
  • Article Data7

Chrysene-5,6-oxide Chemical Properties

Empirical Formula: C18H12O
Molecular Weight: 244.2873g/mol 
Systematic Name: 1a,11c-dihydrochryseno[5,6-b]oxirene
H-Bond Donor: 0
H-Bond Acceptor: 1
SMILES: O2C3c4c(c1c(cccc1)C23)ccc5ccccc45
InChI: InChI=1/C18H12O/c1-2-6-12-11(5-1)9-10-14-13-7-3-4-8-15(13)17-18(19-17)16(12)14/h1-10,17-18H
InChIKey: VYYARLZUMSKDPQ-UHFFFAOYAH 
Surface Tension: 57.8 dyne/cm
Density: 1.285 g/cm3
Flash Point: 212.4 °C
Boiling Point: 447.3 °C at 760 mmHg
Enthalpy of Vaporization: 67.84 kJ/mol 
Vapour Pressure: 9.01E-08 mmHg at 25°C 
Structure of Chrysene-5,6-oxide (CAS NO.15131-84-7):

Chrysene-5,6-oxide Toxicity Data With Reference

1.    

mma-sat 50 µg/plate

    PNASA6    Proceedings of the National Academy of Sciences of the United States of America. 72 (1975),5135.
2.    

dnr-esc 100 µmol/L

    ZKKOBW    Zeitschrift fuer Krebsforschung und Klinische Onkologie. 92 (1978),157.
3.    

dns-esc 100 µmol/L

    ZKKOBW    Zeitschrift fuer Krebsforschung und Klinische Onkologie. 92 (1978),157.

Chrysene-5,6-oxide Consensus Reports

EPA Genetic Toxicology Program.

Chrysene-5,6-oxide Safety Profile

Questionable carcinogen with experimental tumorigenic data. Mutation data reported. When heated to decomposition it emits acrid smoke and fumes. See also CHRYSENE.

Chrysene-5,6-oxide Specification

  Chrysene-5,6-oxide , its cas register number is 15131-84-7. It also can be called Chrysene-5,6-epoxide ; 1a,11c-Dihydrochryseno(5,6-b)oxirene and  5,6-Epoxy-5,6-dihydrochrysene . When heated to decomposition it emits acrid smoke and fumes.

 

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