Molecular Structure of 6-Methoxy-quinazolin-4-ylamine (CAS No.50424-28-7):
Molecular Formula: C9H7ClN2O
Molecular Weight: 194.6177
Systematic Name: 4-Chloro-6-methoxyquinazoline
CAS No: 50424-28-7
H bond acceptors: 3
H bond donors: 0
Freely Rotating Bonds: 1
Index of Refraction: 1.629
Molar Refractivity: 51.851 cm3
Molar Volume: 145.95 cm3
Surface Tension: 52.008 dyne/cm
Density: 1.333 g/cm3
Flash Point: 149.129 °C
Enthalpy of Vaporization: 54.241 kJ/mol
Boiling Point: 322.973 °C at 760 mmHg
Vapour Pressure: 0.001 mmHg at 25°C
SMILES: COc1ccc2c(c1)c(ncn2)Cl
InChI: InChI=1/C9H7ClN2O/c1-13-6-2-3-8-7(4-6)9(10)12-5-11-8/h2-5H,1H3
InChIKey: MREJJMASIQVOTH-UHFFFAOYAN
6-Methoxy-quinazolin-4-ylamine (CAS No.50424-28-7), it also can be called 4-Chloro-6-methoxyquinazoline ; Quinazoline, 4-chloro-6-methoxy- .
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