Molecular Structure of 2-Chloro-4-hydroxyqinoline (CAS NO.771555-21-6):
Systematic Name: 2-Chloroquinolin-4(1H)-one
SMILES: O=C2\C=C(\Cl)Nc1ccccc12
InChI: InChI=1/C9H6ClNO/c10-9-5-8(12)6-3-1-2-4-7(6)11-9/h1-5H,(H,11,12)
InChIKey: ZGFLMSYIISDCLO-UHFFFAOYAA
Empirical Formula: C9H6ClNO
Molecular Weight: 179.603
Nominal Mass: 179 Da
Average Mass: 179.603 Da
Monoisotopic Mass: 179.013792 Da
H bond acceptors: 2
H bond donors: 1
Freely Rotating Bonds: 0
Index of Refraction: 1.641
Molar Refractivity: 46.87 cm3
Molar Volume: 129.8 cm3
Surface Tension: 52.1 dyne/cm
Density: 1.38 g/cm3
Flash Point: 119.4 °C
Enthalpy of Vaporization: 51.22 kJ/mol
Boiling Point: 273.9 °C at 760 mmHg
Vapour Pressure: 0.00559 mmHg at 25 °C
2-Chloro-4-hydroxyqinoline (CAS NO.771555-21-6), its Synonyms are 4-Quinolinol, 2-chloro- ; 2-Chloroquinolin-4-ol .
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