Product Name: Chrysene, dihydro- (9CI)
CAS Registry Number: 41593-31-1
Synonyms: Dihydrochrysene
Systematic Name: Chrysene, dihydro- (9CI)
IUPAC Name: 1,2-dihydrochrysene
Molecular Weight: 230.30376 [g/mol]
Molecular Formula: C18H14
XLogP3-AA: 5.5
Surface Tension: 52.5 dyne/cm
Density: 1.164 g/cm3
Flash Point: 199.4 °C
Enthalpy of Vaporization: 64.74 kJ/mol
Boiling Point: 419.8 °C at 760 mmHg
Vapour Pressure: 7.22E-07 mmHg at 25°C
Following is the molecular structure of Chrysene, dihydro- (9CI) (CAS NO.41593-31-1) is:
1. | ipr-mus TDLo:59 mg/kg/15D-I:CAR | CNREA8 Cancer Research. 39 (1979),5063. |
Questionable carcinogen with experimental carcinogenic data. When heated to decomposition it emits acrid smoke and irritating fumes. See also CHRYSENE.
Descriptors computed from structure, you can know some information about Chrysene, dihydro- (9CI) (CAS NO.41593-31-1) :
Canonical SMILES: C1CC2=C(C=C1)C3=C(C=C2)C4=CC=CC=C4C=C3
InChI: InChI=1S/C18H14/c1-3-7-15-13(5-1)9-11-18-16-8-4-2-6-14(16)10-12-17(15)
18/h1,3-5,7-12H,2,6H2
InChIKey: TVOQZJIIVKIKQU-UHFFFAOYSA-N
Exact Mass: 230.10955
MonoIsotopic Mass: 230.10955
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