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| CAS No.: | 4491-33-2 |
|---|---|
| Name: | Ethyl quinoline-2-carboxylate |
| Article Data: | 2 |
| Molecular Structure: | |
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| Formula: | C12H11NO2 |
| Molecular Weight: | 201.225 |
| Synonyms: | Ethyl 2-quinolinecarboxylate |
| Density: | 1.175 g/cm3 |
| Melting Point: | 30-33 °C(Solv: ethyl ether (60-29-7)) |
| Boiling Point: | 333.9 °C at 760 mmHg |
| Flash Point: | 155.8 °C |
| PSA: | 39.19000 |
| LogP: | 2.41150 |
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Specification
The CAS registry number of Ethyl quinoline-2-carboxylate is 4491-33-2. This chemical's molecular formula is C12H11NO2 and molecular weight is 201.2212. What's more, its systematic name is called Ethyl quinoline-2-carboxylate.
Physical properties about Ethyl quinoline-2-carboxylate are: (1)ACD/LogP: 2.59; (2)#of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 39.19 Å2; (7)Index of Refraction: 1.6; (8)Molar Refractivity: 58.59 cm3; (9)Molar Volume: 171.1 cm3; (10)Surface Tension: 47.7 dyne/cm; (11)Density: 1.175 g/cm3; (12)Flash Point: 155.8 °C; (13)Enthalpy of Vaporization: 57.69 kJ/mol; (14)Boiling Point: 333.9 °C at 760 mmHg; (15)Vapour Pressure: 0.000132 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(OCC)c1nc2ccccc2cc1
(2) InChI: InChI=1/C12H11NO2/c1-2-15-12(14)11-8-7-9-5-3-4-6-10(9)13-11/h3-8H,2H2,1H3
(3) InChIKey: PWOYTBYNBYNZCO-UHFFFAOYAO