Product Name

  • Name

    9-FLUORO-5-METHYLCHRYSENE

  • EINECS
  • CAS No. 64977-48-6
  • Density 1.226g/cm3
  • Solubility
  • Melting Point
  • Formula C19H13F
  • Boiling Point 452.4°Cat760mmHg
  • Molecular Weight 260.32
  • Flash Point 199.4°C
  • Transport Information
  • Appearance
  • Safety Questionable carcinogen with experimental tumorigenic data. Mutation data reported. When heated to decomposition it emits toxic fumes of F−. See also CHRYSENE.
  • Risk Codes
  • Molecular Structure Molecular Structure of 64977-48-6 (9-FLUORO-5-METHYLCHRYSENE)
  • Hazard Symbols
  • Synonyms 9-Fluoro-5-methylchrysene;CHRYSENE,9-FLUORO-5-METHYL;9-Fluor-5-methylchrysen;
  • PSA 0.00000
  • LogP 5.59370

9-Fluoro-5-methylchrysene Chemical Properties

Molecular Formula: C19H13F
Molecular Weight: 260.304923 g/mol
The Molecular Structure of 9-Fluoro-5-methylchrysene (CAS NO.64977-48-6):

IUPAC: 3-fluoro-11-methylchrysene 
Density: 1.226 g/cm3
Flash Point: 199.4 °C
Enthalpy of Vaporization: 68.43 kJ/mol
Boiling Point: 452.4 °C at 760 mmHg
Vapour Pressure: 6.04E-08 mmHg at 25°C 
Index of Refraction: 1.728
Molar Refractivity: 84.59 cm3
Molar Volume: 212.2 cm3
Surface Tension: 49.6 dyne/cm
ACD/LogP: 6.42
ACD/LogD (pH 5.5): 6.42
ACD/LogD (pH 7.4): 6.42
ACD/BCF (pH 5.5): 44755.8
ACD/BCF (pH 7.4): 44755.8
ACD/KOC (pH 5.5): 74243.9
ACD/KOC (pH 7.4): 74243.9 
InChI: InChI=1/C19H13F/c1-12-10-14-6-8-15(20)11-18(14)17-9-7-13-4-2-3-5-16(13)19(12)17/h2-11H,1H3
Smiles: c12c(c3c(ccc(c3)F)cc2C)ccc2c1cccc2 
Classification Code: Mutation data,Tumor data

9-Fluoro-5-methylchrysene Toxicity Data With Reference

1.    

mma-sat 20 µg/plate

     JMCMAR    Journal of Medicinal Chemistry. 21 (1978),38.

9-Fluoro-5-methylchrysene Consensus Reports

EPA Genetic Toxicology Program.

9-Fluoro-5-methylchrysene Safety Profile

Questionable carcinogen with experimental tumorigenic data. Mutation data reported. When heated to decomposition it emits toxic fumes of F−. See also CHRYSENE.

9-Fluoro-5-methylchrysene Specification

 9-Fluoro-5-methylchrysene (CAS NO.64977-48-6) is also called as BRN 2530698 ; Chrysene, 9-fluoro-5-methyl- .

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