IUPAC Name: 6-methylbenzo[a]anthracene
Empirical Formula: C19H14
Molecular Weight: 242.3145g/mol
Structure of 6-Methylbenz(a)anthracene (CAS NO.316-14-3):
Index of Refraction: 1.748
Molar Refractivity: 84.6 cm3
Molar Volume: 208 cm3
Polarizability: 33.54×10-24cm3
Surface Tension: 51.1 dyne/cm
Density: 1.164 g/cm3
Flash Point: 217.8 °C
Enthalpy of Vaporization: 68.09 kJ/mol
Boiling Point: 449.4 °C at 760 mmHg
Vapour Pressure: 7.61E-08 mmHg at 25°C
Classification Code: Mutation data; Tumor data
Canonical SMILES: CC1=CC2=CC=CC=C2C3=CC4=CC=CC=C4C=C13
InChI: InChI=1S/C19H14/c1-13-10-16-8-4-5-9-17(16)19-12-15-7-3-2-6-14(15)11-18(13)19/h2-12H,1H3
InChIKey: WOIBRJNTTODOPT-UHFFFAOYSA-N
1. | mma-sat 10 µg/plate | CNREA8 Cancer Research. 36 (1976),4525. |
EPA Genetic Toxicology Program.
Questionable carcinogen with experimental carcinogenic and tumorigenic data. Mutation data reported. When heated to decomposition it emits acrid smoke and irritating fumes.
6-Methylbenz(a)anthracene , its cas register number is 316-14-3. It also can be called 4-05-00-02564 (Beilstein Handbook Reference) ; 4-Methyl-1,2-benzanthracene ; 6-Methyltetraphene ; BRN 2048520 ; CCRIS 1886 ; NSC 409457 .
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