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| Name |
5-Ethyl-1,2-benzanthracene |
EINECS | N/A |
| CAS No. | 56961-62-7 | Density | 1.141g/cm3 |
| PSA | 0.00000 | LogP | 5.70860 |
| Solubility | N/A | Melting Point |
133.2°C (estimate) |
| Formula | C20H16 | Boiling Point | 457.2°C at 760 mmHg |
| Molecular Weight | 256.36 | Flash Point | 223.6°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. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
BENZ(a)ANTHRACENE,8-ETHYL;8-ethyltetraphene;5-Ethyl-1,2-benzanthracene;5-Aethyl-1,2-benzanthracen;8-Ethylbenz(a)anthracene;8-Aethyl-benz[a]anthracen; |
5-Ethyl-1,2-benzanthracene Chemical Properties
Molecule structure of 5-Ethyl-1,2-benzanthracene (CAS NO.56961-62-7):
IUPAC Name: 8-Ethylbenzo[b]phenanthrene
Molecular Weight: 256.34104 g/mol
Molecular Formula: C20H16
Density: 1.141 g/cm3
Boiling Point: 457.2 °C at 760 mmHg |
Flash Point: 223.6 °C
Index of Refraction: 1.726
Molar Refractivity: 89.32 cm3
Molar Volume: 224.5 cm3
Polarizability: 35.41×10-24 cm3
Surface Tension: 49.3 dyne/cm
Enthalpy of Vaporization: 68.98 kJ/mol
Vapour Pressure: 4.13E-08 mmHg at 25 °C
XLogP3: 6.9
Rotatable Bond Count: 1
Exact Mass: 256.125201
MonoIsotopic Mass: 256.125201
Heavy Atom Count: 20
Complexity: 333
Canonical SMILES: CCC1=CC=CC2=CC3=C(C=CC4=CC=CC=C43)C=C21
InChI: InChI=1S/C20H16/c1-2-14-7-5-8-16-13-20-17(12-19(14)16)11-10-15-6-3-4-9-18(15)20/h3-13H,2H2,1H3
InChIKey: BQKRLUQCYVLAAO-UHFFFAOYSA-N
Classification Code of 5-Ethyl-1,2-benzanthracene (CAS NO.56961-62-7): Tumor data
5-Ethyl-1,2-benzanthracene Safety Profile
Questionable carcinogen with experimental tumorigenic data. When heated to decomposition it emits acrid smoke and irritating fumes.
5-Ethyl-1,2-benzanthracene Specification
5-Ethyl-1,2-benzanthracene (CAS NO.56961-62-7) is also named as 4-05-00-02585 (Beilstein Handbook Reference) ; 8-Ethylbenz(a)anthracene ; BRN 2523267 ; Benz(a)anthracene, 8-ethyl- .
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