5,6-Dimethylchrysene supplier

Name
5,6-dimethylchrysene
EINECS
CAS No. 3697-27-6
Article Data6
CAS DataBase
Density 1.142g/cm³
Solubility 25ug/L(27 oC)
Melting Point 129.3°C
Formula C₂₀H₁₆
Boiling Point 466.5°Cat760mmHg
Molecular Weight 256.36
Flash Point 229.1°C
Transport Information
Appearance
Safety Questionable carcinogen with experimental tumorigenic data. When heated to decomposition it emits acrid smoke and irritating fumes. See also CHRYSENE.
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Chrysene,5,6-dimethyl;5,6-Dimethylchrysen;Chrysene, 5,6-dimethyl-;1,2-Dimethylchrysen;5,6-dimethyl-chrysene;
PSA 0.00000
LogP 5.76300

5,6-Dimethylchrysene Chemical Properties

Molecule structure of 5,6-Dimethylchrysene (CAS NO.3697-27-6):

IUPAC Name: 5,6-Dimethylchrysene
Molecular Weight: 256.34104 g/mol
Molecular Formula: C₂₀H₁₆
Density: 1.142 g/cm³
Boiling Point: 466.5 °C at 760 mmHg
Flash Point: 229.1 °C
Index of Refraction: 1.728
Molar Refractivity: 89.43 cm³
Molar Volume: 224.3 cm³
Polarizability: 35.45×10^-24 cm³
Surface Tension: 49.1 dyne/cm
Enthalpy of Vaporization: 70.04 kJ/mol
Vapour Pressure: 1.97E-08 mmHg at 25 °C
XLogP3-AA: 6.4
Exact Mass: 256.125201
MonoIsotopic Mass: 256.125201
Heavy Atom Count: 20
Complexity: 346
Canonical SMILES: CC1=C(C2=C(C=CC3=CC=CC=C32)C4=CC=CC=C14)C
InChI: InChI=1S/C20H16/c1-13-14(2)20-17-9-4-3-7-15(17)11-12-19(20)18-10-6-5-8-16(13)18/h3-12H,1-2H3
InChIKey of 5,6-Dimethylchrysene (CAS NO.3697-27-6): SDOJHDGZFOGOFD-UHFFFAOYSA-N

5,6-Dimethylchrysene Safety Profile

Questionable carcinogen with experimental tumorigenic data. When heated to decomposition it emits acrid smoke and irritating fumes. See also CHRYSENE.

5,6-Dimethylchrysene Specification

5,6-Dimethylchrysene (CAS NO.3697-27-6) is also named as 4-05-00-02590 (Beilstein Handbook Reference) ; BRN 2266344 ; Chrysene, 5,6-dimethyl- .

Product Name

5,6-dimethylchrysene

5,6-Dimethylchrysene Chemical Properties

5,6-Dimethylchrysene Safety Profile

5,6-Dimethylchrysene Specification

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