IUPAC Name: 7,12-Dimethyl-8,9,10,11-tetrahydrobenzo[b]phenanthrene
Synonyms of 7,12-Dimethyl-8,9,10,11-tetrahydrobenz(a)anthracene (CAS NO.25486-91-3): 8,9,10,11-Tetrahydro-7,12-dimethylbenz(a)anthracene ; Benz(a)anthracene, 8,9,10,11-tetrahydro-7,12-dimethyl-
CAS NO: 25486-91-3
Molecular Formula: C20H20
Molecular Weight: 260.3728
Molecular Structure :
H bond acceptors: 0
H bond donors: 0
Freely Rotating Bonds: 0
Polar Surface Area: 0 Å2
Index of Refraction: 1.668
Molar Refractivity: 88.37 cm3
Molar Volume: 237 cm3
Surface Tension: 45.7 dyne/cm
Density: 1.098 g/cm3
Flash Point: 217.9 °C
Enthalpy of Vaporization: 67.77 kJ/mol
Boiling Point: 446.6 °C at 760 mmHg
Vapour Pressure: 9.47E-08 mmHg at 25°C
InChI: InChI=1/C20H20/c1-13-16-8-5-6-9-17(16)14(2)20-18(13)12-11-15-7-3-4-10-19(15)20/h3-4,7,10-12H,5-6,8-9H2,1-2H3
InChIKey: YHUGRZOJDNHSJC-UHFFFAOYAZ
Std. InChI: InChI=1S/C20H20/c1-13-16-8-5-6-9-17(16)14(2)20-18(13)12-11-15-7-3-4-10-19(15)20/h3-4,7,10-12H,5-6,8-9H2,1-2H3
Std. InChIKey: YHUGRZOJDNHSJC-UHFFFAOYSA-N
Questionable carcinogen with experimental tumorigenic data. When 7,12-Dimethyl-8,9,10,11-tetrahydrobenz(a)anthracene (CAS NO.25486-91-3) is heated to decomposition ,it emits acrid smoke and irritating fumes.
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