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| Name |
Phenanthrene, 9-(2-methyl-1-cyclohexen-1-yl)- |
EINECS | N/A |
| CAS No. | 6272-57-7 | Density | 1.097 g/cm3 |
| PSA | N/A | LogP | N/A |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C21H20 | Boiling Point | 450.9 °C at 760 mmHg |
| Molecular Weight | 272.38 | Flash Point | 221.2 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
NSC 30873;9-(2-Methylcyclohex-1-en-1-yl)phenanthrene; |
Phenanthrene, 9-(2-methyl-1-cyclohexen-1-yl)- Specification
The Phenanthrene, 9-(2-methyl-1-cyclohexen-1-yl)- has the CAS registry number 6272-57-7. This chemical's molecular formula is C21H20 and molecular weight is 272.38. What's more, its systematic name is 9-(2-Methylcyclohex-1-en-1-yl)phenanthrene.
Physical properties of Phenanthrene, 9-(2-methyl-1-cyclohexen-1-yl)- are: (1)ACD/LogP: 7.40; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 0; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Index of Refraction: 1.664; (7)Molar Refractivity: 92.1 cm3; (8)Molar Volume: 248.1 cm3; (9)Polarizability: 36.51×10-24 cm3; (10)Surface Tension: 45.5 dyne/cm; (11)Density: 1.097 g/cm3; (12)Flash Point: 221.2 °C; (13)Enthalpy of Vaporization: 68.26 kJ/mol; (14)Boiling Point: 450.9 °C at 760 mmHg; (15)Vapour Pressure: 6.76E-08 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: c34cc(/C1=C(/CCCC1)C)c2ccccc2c3cccc4
(2)InChI: InChI=1/C21H20/c1-15-8-2-4-10-17(15)21-14-16-9-3-5-11-18(16)19-12-6-7-13-20(19)21/h3,5-7,9,11-14H,2,4,8,10H2,1H3
(3)InChIKey: FQELDELIFBKUDR-UHFFFAOYSA-N
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