Product Name

  • Name

    7-hydroxymethyl-12-methylbenz(a)anthracene

  • EINECS
  • CAS No. 568-75-2
  • Article Data5
  • CAS DataBase
  • Density 1.227g/cm3
  • Solubility
  • Melting Point 162-163 °C
  • Formula C20H16 O
  • Boiling Point 523.8°C at 760 mmHg
  • Molecular Weight 272.36
  • Flash Point 225.9°C
  • Transport Information
  • Appearance
  • Safety Poison by intravenous route. Experimental teratogenic and reproductive effects. Questionable carcinogen with experimental carcinogenic, neoplastigenic, and tumorigenic data. Mutation data reported. When heated to decomposition it emits acrid smoke and fumes.
  • Risk Codes
  • Molecular Structure Molecular Structure of 568-75-2 (7-hydroxymethyl-12-methylbenz(a)anthracene)
  • Hazard Symbols
  • Synonyms 7-(Hydroxymethyl)-12-methylbenz[a]anthracene
  • PSA 20.23000
  • LogP 4.94690

7-Hydroxymethyl-12-methylbenz(a)anthracene Chemical Properties

Product Name: 7-Hydroxymethyl-12-methylbenz(a)anthracene (CAS NO.568-75-2)


Molecular Formula: C20H16O
Molecular Weight: 272.36g/mol
Mol File: 568-75-2.mol
Boiling point: 523.8 °C at 760 mmHg
Storage Temperature:
Flash Point: 225.9 °C
Density: 1.227 g/cm3
Surface Tension: 57.1 dyne/cm
Enthalpy of Vaporization: 83.96 kJ/mol
Vapour Pressure: 8.45E-12 mmHg at 25°C
XLogP3-AA: 4.5
H-Bond Donor: 1
H-Bond Acceptor: 1
IUPAC Name: (12-methylbenzo[b]phenanthren-7-yl)methanol
Canonical SMILES: CC1=C2C(=C(C3=CC=CC=C13)CO)C=CC4=CC=CC=C42
InChI: InChI=1S/C20H16O/c1-13-15-7-4-5-9-17(15)19(12-21)18-11-10-14-6-2-3-8-16
(14)20(13)18/h2-11,21H,12H2,1H3 
InChIKey: JCBBZYDVQJQMMB-UHFFFAOYSA-N

7-Hydroxymethyl-12-methylbenz(a)anthracene Toxicity Data With Reference

1.    

dnd-rat-ipr 100 µmol/kg

     CRNGDP    Carcinogenesis. 3 (1982),297.
2.    

dnd-mus-skn 16 µmol/kg

     CNREA8    Cancer Research. 43 (1983),4221.
3.    

ivn-rat LD50:73 mg/kg

     KIDZAK    Kansai Ika Daigaku Zasshi. Journal of the Kansai Medical School. 23 (Suppl 1)(1971),35.

7-Hydroxymethyl-12-methylbenz(a)anthracene Consensus Reports

EPA Genetic Toxicology Program.

7-Hydroxymethyl-12-methylbenz(a)anthracene Safety Profile

Poison by intravenous route. Experimental teratogenic and reproductive effects. Questionable carcinogen with experimental carcinogenic, neoplastigenic, and tumorigenic data. Mutation data reported. When heated to decomposition it emits acrid smoke and fumes.

7-Hydroxymethyl-12-methylbenz(a)anthracene Specification

 7-Hydroxymethyl-12-methylbenz(a)anthracene ,its CAS NO. is 568-75-2,the synonyms is (12-methylbenzo[b]phenanthren-7-yl)methanol ; 12-Methylbenz(a)anthracene-7-methanol ; Benz(a)anthracene-7-methanol, 12-methyl- .

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