The CAS register number of 1-(4-Aminophenyl)-1H-pyridin-2-one is 13143-47-0. It also can be called as 2(1H)-Pyridinone,1-(4-aminophenyl)- and the systematic name about this chemical is 1-(4-aminophenyl)pyridin-2(1H)-one. The molecular formula about this chemical is C11H10N2O and the molecular weight is 186.21.
Physical properties about 1-(4-Aminophenyl)-1H-pyridin-2-one are: (1)ACD/LogP: -1.11; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 22; (5)ACD/KOC (pH 7.4): 22; (6)#H bond acceptors: 3; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 46.33Å2; (10)Index of Refraction: 1.665; (11)Molar Refractivity: 54.643 cm3; (12)Molar Volume: 147.066 cm3; (13)Polarizability: 21.662x10-24cm3; (14)Surface Tension: 59.887 dyne/cm; (15)Enthalpy of Vaporization: 67.688 kJ/mol; (16)Boiling Point: 422.666 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C2/C=C\C=C/N2c1ccc(N)cc1
(2)InChI: InChI=1/C11H10N2O/c12-9-4-6-10(7-5-9)13-8-2-1-3-11(13)14/h1-8H,12H2
(3)InChIKey: LXFHLDJQBIZFOP-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/C11H10N2O/c12-9-4-6-10(7-5-9)13-8-2-1-3-11(13)14/h1-8H,12H2
(5)Std. InChIKey: LXFHLDJQBIZFOP-UHFFFAOYSA-N
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