Product Name: 7-Methoxy-12-methylbenz(a)anthracene (CAS NO.16354-47-5)
Molecular Formula: C20H16O
Molecular Weight: 272.36g/mol
Mol File: 16354-47-5.mol
Boiling point: 481.5 °C at 760 mmHg
Storage Temperature:
Flash Point: 198.7 °C
Density: 1.173 g/cm3
Surface Tension: 48.7 dyne/cm
Enthalpy of Vaporization: 71.77 kJ/mol
Vapour Pressure: 5.8E-09 mmHg at 25°C
XLogP3-AA: 6
H-Bond Donor: 0
H-Bond Acceptor: 1
IUPAC Name: 7-methoxy-12-methylbenzo[b]phenanthrene
Canonical SMILES: CC1=C2C(=C(C3=CC=CC=C13)OC)C=CC4=CC=CC=C42
InChI: InChI=1S/C20H16O/c1-13-15-8-5-6-10-17(15)20(21-2)18-12-11-14-7-3-4-9-16
(14)19(13)18/h3-12H,1-2H3
InChIKey: NYOGCOVCKPOSCX-UHFFFAOYSA-N
Questionable carcinogen with experimental neoplastigenic data. When heated to decomposition it emits acrid smoke and irritating fumes.
7-Methoxy-12-methylbenz(a)anthracene ,its CAS NO. is 16354-47-5,the synonyms is Benz(a)anthracene, 7-methoxy-12-methyl- .
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