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8-Chloro-7-methoxy-2-[4-(1-methylethyl)-2-thiazolyl]-4-quinolinol

  • Name 8-Chloro-7-methoxy-2-[4-(1-methylethyl)-2-thiazolyl]-4-quinolinol
  • EINECSN/A
  • CAS No. 923289-39-8
  • Density1.343
  • PSA83.48000
  • LogP4.84930
  • SolubilityN/A
  • Melting PointN/A
  • FormulaC16H15 Cl N2 O2 S
  • Boiling Point536.2 ºC at 760 mmHg
  • Molecular Weight334.826
  • Flash Point278.1 ºC
  • Transport InformationN/A
  • AppearanceN/A
  • Safety
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 923289-39-8 (4-Quinolinol, 8-chloro-7-methoxy-2-[4-(1-methylethyl)-2-thiazolyl]-)
  • Hazard SymbolsN/A
  • SynonymsN/A
  • Article Data5

8-Chloro-7-methoxy-2-[4-(1-methylethyl)-2-thiazolyl]-4-quinolinol 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

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