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CAS No.: | 16354-50-0 |
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Name: | 7-ETHYL-12-METHYLBENZ(A)ANTHRACENE |
Molecular Structure: | |
Formula: | C21H18 |
Molecular Weight: | 270.374 |
Synonyms: | 7-Ethyl-12-methylbenz[a]anthracene |
Density: | 1.122g/cm3 |
Melting Point: | 70-71.5 °C |
Boiling Point: | 470.5°Cat760mmHg |
Flash Point: | 232.6°C |
Safety: | Questionable carcinogen with experimental neoplastigenic and tumorigenic data. Mutation data reported. When heated to decomposition it emits acrid smoke and irritating fumes. |
PSA: | 0.00000 |
LogP: | 6.01700 |
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The Molecular Structure of 7-Ethyl-12-methylbenz(a)anthracene (CAS NO.16354-50-0):
Molecular Formula: C21H18
Molecular Weight: 270.367620 g/mol
Index of Refraction: 1.71
Molar Refractivity: 94.15 cm3
Molar Volume: 240.8 cm3
Surface Tension: 47.6 dyne/cm
Density: 1.122 g/cm3
Flash Point: 232.6 °C
Enthalpy of Vaporization: 70.5 kJ/mol
Boiling Point: 470.5 °C at 760 mmHg
Vapour Pressure: 1.43E-08 mmHg at 25°C
Classification Code: Mutation data,Tumor data
InChI
InChI=1/C21H18/c1-3-16-19-11-7-6-9-17(19)14(2)21-18-10-5-4-8-15(18)12-13-20(16)21/h4-13H,3H2,1-2H3
Smiles
c12c(c(CC)c3c(c1C)cccc3)ccc1c2cccc1
The IUPAC of 7-Ethyl-12-methylbenz(a)anthracene (CAS NO.16354-50-0) is 7-ethyl-12-methylbenzo[b]phenanthrene .
1. | cyt-rat-ivn 50 mg/kg | GANNA2 Gann. Japanese Journal of Cancer Research. 64 (1973),637. |
Questionable carcinogen with experimental neoplastigenic and tumorigenic data. Mutation data reported. When heated to decomposition it emits acrid smoke and irritating fumes.
7-Ethyl-12-methylbenz(a)anthracene (CAS NO.16354-50-0) is also called as 4-05-00-02598 (Beilstein Handbook Reference) ; BRN 3301533 ; CCRIS 1535 ; Benz(a)anthracene, 7-ethyl-12-methyl- .