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CAS No.: | 205448-31-3 |
---|---|
Name: | 4-chloro-6-methoxyquinolin-7-ol |
Article Data: | 6 |
Molecular Structure: | |
Formula: | C10H8ClNO2 |
Molecular Weight: | 209.632 |
Synonyms: | 4-Chloro-7-hydroxy-6-methoxyquinoline;4-Chloro-6-methoxyquinolin-7-ol; |
Density: | 1.387 g/cm3 |
Boiling Point: | 353.279 °C at 760 mmHg |
Flash Point: | 167.457 °C |
PSA: | 42.35000 |
LogP: | 2.60240 |
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The 4-Chloro-6-methoxyquinolin-7-ol, with the CAS registry number 205448-31-3, is also known as 4-Chloro-7-hydroxy-6-methoxyquinoline. This chemical's molecular formula is C10H8ClNO2 and molecular weight is 209.63. What's more, its systematic name is 4-Chloro-6-methoxy-7-quinolinol.
Physical properties of 4-Chloro-6-methoxyquinolin-7-ol are: (1)ACD/LogP: 2.554; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.52; (4)ACD/LogD (pH 7.4): 2.50; (5)ACD/BCF (pH 5.5): 47.75; (6)ACD/BCF (pH 7.4): 45.08; (7)ACD/KOC (pH 5.5): 542.39; (8)ACD/KOC (pH 7.4): 512.04; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 42.35 Å2; (13)Index of Refraction: 1.658; (14)Molar Refractivity: 55.642 cm3; (15)Molar Volume: 151.156 cm3; (16)Polarizability: 22.058×10-24cm3; (17)Surface Tension: 55.6 dyne/cm; (18)Density: 1.387 g/cm3; (19)Flash Point: 167.457 °C; (20)Enthalpy of Vaporization: 62.179 kJ/mol; (21)Boiling Point: 353.279 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Oc1cc2nccc(Cl)c2cc1OC;
(2)Std. InChI: InChI=1S/C10H8ClNO2/c1-14-10-4-6-7(11)2-3-12-8(6)5-9(10)13/h2-5,13H,1H3;
(3)Std. InChIKey: NKWZPFHSWLSOON-UHFFFAOYSA-N;