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Cas Database |
| Name |
12-Ethyl-7-Methylbenz(A)Anthracene |
EINECS | N/A |
| CAS No. | 16354-55-5 | Density | 1.122g/cm3 |
| PSA | 0.00000 | LogP | 6.01700 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C21H18 | Boiling Point | 470.5°Cat760mmHg |
| Molecular Weight | 270.374 | Flash Point | 232.6°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Questionable carcinogen with experimental neoplastigenic data. Mutation data reported. When heated to decomposition it emits acrid smoke and irritating fumes. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
7-Methyl-12-ethylbenz[a]anthracene |
Article Data | 2 |
12-Ethyl-7-Methylbenz(A)Anthracene Chemical Properties
Chemistry informtion about 12-Ethyl-7-Methylbenz(A)Anthracene(CAS NO.16354-55-5) is:
IUPAC Name: 12-ethyl-7-methylbenzo[b]phenanthrene
Synonyms: 12-Ethyl-7-methylbenz(a)anthracene ; 3-05-00-02426 (Beilstein Handbook Reference) ; BRN 3054830 ; CCRIS 1536
Systematic Name: 7-Methyl-12-ethylbenz(a)anthracene ; Benz(a)anthracene, 12-ethyl-7-methyl-
Molecular Weight: 270.36762 [g/mol]
Molecular Formula: C21H18
XLogP3: 6.2
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
Following is the molecular structure of 12-Ethyl-7-Methylbenz(A)Anthracene(CAS NO.16354-55-5) is:
12-Ethyl-7-Methylbenz(A)Anthracene Toxicity Data With Reference
| 1. | cyt-rat-ivn 50 mg/kg | GANNA2 Gann. Japanese Journal of Cancer Research. 64 (1973),637. |
12-Ethyl-7-Methylbenz(A)Anthracene Safety Profile
Questionable carcinogen with experimental neoplastigenic data. Mutation data reported. When heated to decomposition it emits acrid smoke and irritating fumes.
12-Ethyl-7-Methylbenz(A)Anthracene Specification
Descriptors Computed from Structure about 12-Ethyl-7-Methylbenz(A)Anthracene(CAS NO.16354-55-5) is:
Canonical SMILES: CCC1=C2C(=C(C3=CC=CC=C31)C)C=CC4=CC=CC=C42
InChI: InChI=1S/C21H18/c1-3-16-20-11-7-6-9-17(20)14(2)18-13-12-15-8-4-5-10-19(15)21(16)18/h4-13H,3H2,1-2H3
InChIKey: FTMBVQWARWOALX-UHFFFAOYSA-N
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