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| CAS No.: | 92172-83-3 |
|---|---|
| Name: | 2-CHLORO-6-METHOXYQUINOLINE-3-METHANOL |
| Molecular Structure: | |
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| Formula: | C11H10ClNO2 |
| Molecular Weight: | 223.659 |
| Synonyms: | (2-Chloro-6-methoxyquinolin-3-yl)methanol; |
| Density: | 1.342 g/cm3 |
| Melting Point: | 133 °C |
| Boiling Point: | 391.4 °C at 760 mmHg |
| Flash Point: | 190.5 °C |
| Hazard Symbols: | Xn |
| Risk Codes: | 22-41 |
| Safety: | 26-39 |
| PSA: | 42.35000 |
| LogP: | 2.38910 |
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Specification
This chemical is called 3-Quinolinemethanol, 2-chloro-6-methoxy-, and its systematic name is (2-chloro-6-methoxyquinolin-3-yl)methanol. With the molecular formula of C11H10ClNO2, its molecular weight is 223.66. The CAS registry number of this chemical is 92172-83-3.
Other characteristics of the 3-Quinolinemethanol, 2-chloro-6-methoxy- can be summarised as followings: (1)ACD/LogP: 1.62; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 31.35 Å2; (7)Index of Refraction: 1.642; (8)Molar Refractivity: 60.21 cm3; (9)Molar Volume: 166.5 cm3; (10)Polarizability: 23.86×10-24cm3; (11)Surface Tension: 53.9 dyne/cm; (12)Density: 1.342 g/cm3; (13)Flash Point: 190.5 °C; (14)Enthalpy of Vaporization: 67.61 kJ/mol; (15)Boiling Point: 391.4 °C at 760 mmHg; (16)Vapour Pressure: 7.89E-07 mmHg at 25°C.
Production method of this chemical: The 3-Quinolinemethanol, 2-chloro-6-methoxy- could be obtained by the reactant of 2-chloro-6-methoxy-quinoline-3-carbaldehyde. This reaction needs the reagent of sodium, and the solvent of methanol. The yield is 80 %.
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You can still convert the following datas into molecular structure:
1.SMILES: Clc1nc2ccc(OC)cc2cc1CO
2.InChI: InChI=1/C11H10ClNO2/c1-15-9-2-3-10-7(5-9)4-8(6-14)11(12)13-10/h2-5,14H,6H2,1H3
3.InChIKey: AKKPSGFLKITYGV-UHFFFAOYAW