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| CAS No.: | 923289-39-8 |
|---|---|
| Name: | 4-Quinolinol, 8-chloro-7-methoxy-2-[4-(1-methylethyl)-2-thiazolyl]- |
| Article Data: | 5 |
| Molecular Structure: | |
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| Formula: | C16H15 Cl N2 O2 S |
| Molecular Weight: | 334.826 |
| Synonyms: | 4-Quinolinol, 8-chloro-7-methoxy-2-[4-(1-methylethyl)-2-thiazolyl]-;8-chloro-2-(4-isopropylthiazol-2-yl)-7-methoxyquinolin-4-ol;8-Chloro-7-methoxy-2-[4-(1-methylethyl)-2-thiazolyl]-4-quinolinol;8-chloro-7-Methoxy-2-[4-(1-Methylethyl)-2-thiazolyl]- |
| Density: | 1.343 |
| Boiling Point: | 536.2 ºC at 760 mmHg |
| Flash Point: | 278.1 ºC |
| PSA: | 83.48000 |
| LogP: | 4.84930 |
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- Total:30 Page 1 of 1 1
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Specification
The 8-Chloro-7-methoxy-2-[4-(1-methylethyl)-2-thiazolyl]-4-quinolinol, with the cas registry number 923289-39-8, has the systematic name of 8-chloro-2-(4-isopropylthiazol-2-yl)-7-methoxy-quinolin-4-ol. And its product categories are including API intermediates.
The physical properties of this chemical are as follows: (1)ACD/LogP: 5.54; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.49; (4)ACD/LogD (pH 7.4): 4.6 ; (5)#H bond acceptors: 4; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 4; (8)Polar Surface Area: 83.48; (9)Index of Refraction: 1.649; (10)Molar Refractivity: 90.89 cm3; (11)Molar Volume: 249.2 cm3; (12)Polarizability: 36.03 ×10-24 cm3; (13)Surface Tension: 54.9 dyne/cm; (14)Density: 1.343 g/cm3; (15)Flash Point: 278.1 °C; (16)Enthalpy of Vaporization: 84.34 kJ/mol; (17)Boiling Point: 536.2 °C at 760 mmHg; (18)Vapour Pressure: 4.1E-12 mmHg at 25°C.
In addition, you could convert the following datas into the molecular structure:
(1)SMILES:CC(C)c1csc(n1)c2cc(c3ccc(c(c3n2)Cl)OC)O
(2)InChI:InChI=1/C16H15ClN2O2S/c1-8(2)11-7-22-16(19-11)10-6-12(20)9-4-5-13(21-3)14(17)15(9)18-10/h4-8H,1-3H3,(H,18,20)
(3)InChIKey:UNJWJSFDEJPNML-UHFFFAOYAU