Product Name: Dibenzo(def,p)chrysene-10-carboxaldehyde (CAS NO.2869-59-2)
Molecular Formula: C25H14O
Molecular Weight: 330.39g/mol
Mol File: 2869-59-2.mol
Boiling point: 606.9 °C at 760 mmHg
Flash Point: 419.9 °C
Density: 1.365 g/cm3
Surface Tension: 71.1 dyne/cm
Enthalpy of Vaporization: 90.2 kJ/mol
Vapour Pressure: 1.12E-14 mmHg at 25°C
XLogP3-AA: 7
H-Bond Donor: 0
H-Bond Acceptor: 1
Structure Descriptors of Dibenzo(def,p)chrysene-10-carboxaldehyde (CAS NO.2869-59-2):
Canonical SMILES: C1=CC=C2C(=C1)C3=CC=CC4=C3C5=C(C=C4)C=C6C=CC=C(C6=C25)C=O
InChI: InChI=1S/C25H14O/c26-14-18-7-3-6-16-13-17-12-11-15-5-4-10-20-19-8-1-2-9-21(19)25(22(16)18)24(17)23(15)20/h1-14H
InChIKey: DVAKHPKKSJBUQF-UHFFFAOYSA-N
Questionable carcinogen with experimental tumorigenic data. When heated to decomposition it emits acrid smoke and irritating fumes.
Dibenzo(def,p)chrysene-10-carboxaldehyde ,its CAS NO. is 2869-59-2,the synonyms is 5-Formyl-1,2:3,4-dibenzopyrene ; BRN 1996013 .
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