IUPAC Name: 6,7-dimethylbenzo[a]anthracene
Empirical Formula: C20H16
Molecular Weight: 256.34g/mol
Structure of 6,7-Dimethylbenz(a)anthracene (CAS NO.20627-28-5):
Index of Refraction: 1.728
Molar Refractivity: 89.43 cm3
Molar Volume: 224.3 cm3
Polarizability: 35.45×10-24cm3
Surface Tension: 49.1 dyne/cm
Density: 1.142 g/cm3
Flash Point: 230 °C
Enthalpy of Vaporization: 70.22 kJ/mol
Boiling Point: 468 °C at 760 mmHg
Vapour Pressure: 1.74E-08 mmHg at 25°C
Classification Code: Tumor data
Canonical SMILES: CC1=CC2=CC=CC=C2C3=CC4=CC=CC=C4C(=C13)C
InChI: InChI=1S/C20H16/c1-13-11-15-7-4-6-10-18(15)19-12-16-8-3-5-9-17(16)14(2)20(13)19/h3-12H,1-2H3
InChIKey: WPDOEEIWRBGJOK-UHFFFAOYSA-N
Questionable carcinogen with experimental tumorigenic data. When heated to decomposition it emits acrid smoke and fumes. See also DIMETHYLBENZANTHRACENE.
6,7-Dimethylbenz(a)anthracene , its cas register number is 20627-28-5. It also can be called 3-05-00-02412 (Beilstein Handbook Reference) ; 4,10-Dimethyl-1,2-benzanthracene ; BRN 1963004 . When heated to decomposition it emits acrid smoke and fumes.
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