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5,9-Dimethyl-1,2-benzanthracene

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Name

5,9-Dimethyl-1,2-benzanthracene

EINECS N/A
CAS No. 20627-31-0 Density 1.142g/cm3
PSA 0.00000 LogP 5.76300
Solubility N/A Melting Point 135°C
Formula C20H16 Boiling Point 463.5°Cat760mmHg
Molecular Weight 256.36 Flash Point 227.3°C
Transport Information N/A Appearance N/A
Safety Questionable carcinogen with experimental tumorigenic data. When heated to decomposition it emits acrid smoke and irritating fumes. See also DIMETHYLBENZANTHRACENE. Risk Codes N/A
Molecular Structure Molecular Structure of 20627-31-0 (8,12-Dimethylbenz[a]anthracene) Hazard Symbols N/A
Synonyms

7,12-Dimethyl-benzanthracen;8,12-Dimethylbenzanthracen;8,12-Dimethyl-benzanthracen;5,9-Dimethyl-1,2-benzanthracene;

 

5,9-Dimethyl-1,2-benzanthracene Chemical Properties

IUPAC Name: 8,12-dimethylbenzo[b]phenanthrene 
Empirical Formula: C20H16
Molecular Weight: 256.34g/mol
Structure of 5,9-Dimethyl-1,2-benzanthracene (CAS NO.20627-31-0):

Index of Refraction: 1.728
Molar Refractivity: 89.43 cm3
Molar Volume: 224.3 cm3
Polarizability: 35.45×10-24cm3
Surface Tension: 49.1 dyne/cm
Density: 1.142 g/cm3
Flash Point: 227.3 °C
Enthalpy of Vaporization: 69.69 kJ/mol
Boiling Point: 463.5 °C at 760 mmHg
Vapour Pressure: 2.51E-08 mmHg at 25°C 
Classification Code: Tumor data 
Canonical SMILES: CC1=CC=CC2=C1C=C3C=CC4=CC=CC=C4C3=C2C
InChI: InChI=1S/C20H16/c1-13-6-5-9-17-14(2)20-16(12-19(13)17)11-10-15-7-3-4-8-18(15)20/h3-12H,1-2H3
InChIKey: FBIFSZUQMIZITB-UHFFFAOYSA-N

5,9-Dimethyl-1,2-benzanthracene Safety Profile

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

5,9-Dimethyl-1,2-benzanthracene Specification

  5,9-Dimethyl-1,2-benzanthracene , its cas register number is 20627-31-0. It also can be called -05-00-02415 (Beilstein Handbook Reference) ; 8,12-Dimethylbenz(a)anthracene ; BRN 1959352 . When 5,9-Dimethyl-1,2-benzanthracene (CAS NO.20627-31-0) is heated to decomposition it emits acrid smoke and irritating fumes.

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