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23059-22-5

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Basic Information
CAS No.: 23059-22-5
Name: N-(3-METHOXYPHENYL)-3-OXO-3-PYRIDIN-3-YLPROPANAMIDE
Molecular Structure:
Molecular Structure of 23059-22-5 (N-(3-METHOXYPHENYL)-3-OXO-3-PYRIDIN-3-YLPROPANAMIDE)
Formula: C15H14N2O3
Molecular Weight: 270.2833
Synonyms: N-(3-Methoxyphenyl)-3-oxo-3-pyridin-3-ylpropanamide;
Density: 1.253 g/cm3
Boiling Point: 534.8 °C at 760 mmHg
Flash Point: 277.2 °C
PSA: 68.29000
LogP: 2.37470
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Specification

The CAS registry number of 3-Pyridinepropanamide,N-(3-methoxyphenyl)-b-oxo- is 23059-22-5. This chemical's molecular formula is C15H14N2O3 and molecular weight is 270.2833. What's more, its systematic name is called N-(3-Methoxyphenyl)-3-oxo-3-pyridin-3-ylpropanamide.

Physical properties about 3-Pyridinepropanamide,N-(3-methoxyphenyl)-b-oxo- are: (1)ACD/LogP: 1.53; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.53; (4)ACD/LogD (pH 7.4): 1.51; (5)ACD/BCF (pH 5.5): 8.56; (6)ACD/BCF (pH 7.4): 8.11; (7)ACD/KOC (pH 5.5): 161.48; (8)ACD/KOC (pH 7.4): 153.1; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 59.5 Å2; (13)Index of Refraction: 1.611; (14)Molar Refractivity: 74.89 cm3; (15)Molar Volume: 215.6 cm3; (16)Polarizability: 29.69×10-24 cm3; (17)Surface Tension: 53.1 dyne/cm; (18)Density: 1.253 g/cm3; (19)Flash Point: 277.2 °C; (20)Enthalpy of Vaporization: 81.11 kJ/mol; (21)Boiling Point: 534.8 °C at 760 mmHg; (22)Vapour Pressure: 1.63E-11 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(c1cccnc1)CC(=O)Nc2cccc(OC)c2
(2) InChI: InChI=1/C15H14N2O3/c1-20-13-6-2-5-12(8-13)17-15(19)9-14(18)11-4-3-7-16-10-11/h2-8,10H,9H2,1H3,(H,17,19)
(3) InChIKey: PIFFCRQQXKDXJQ-UHFFFAOYAV