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CAS No.: | 52884-95-4 |
---|---|
Name: | 2-oxo-N-phenylhexanamide |
Article Data: | 9 |
Molecular Structure: | |
Formula: | C12H15NO2 |
Molecular Weight: | 205.257 |
Synonyms: | 2-Oxo-N-phenylhexanamide; |
Density: | 1.105g/cm3 |
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The Hexanamide,2-oxo-N-phenyl-, with the CAS registry number 52884-95-4, is also known as 2-Oxo-N-phenylhexanamide. This chemical's molecular formula is C12H15NO2 and molecular weight is 205.253.
Physical properties about Hexanamide,2-oxo-N-phenyl- are: (1)ACD/LogP: 2.23; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.23; (4)ACD/LogD (pH 7.4): 2.23; (5)ACD/BCF (pH 5.5): 29.29; (6)ACD/BCF (pH 7.4): 29.28; (7)ACD/KOC (pH 5.5): 390.36; (8)ACD/KOC (pH 7.4): 390.29; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 37.38 Å2; (13)Index of Refraction: 1.549; (14)Molar Refractivity: 59.08 cm3; (15)Molar Volume: 185.6 cm3; (16)Surface Tension: 42.9 dyne/cm; (17)Density: 1.105 g/cm3.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(Nc1ccccc1)C(=O)CCCC
(2) InChI: InChI=1/C12H15NO2/c1-2-3-9-11(14)12(15)13-10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3,(H,13,15)
(3) InChIKey: QCRNYWFCFBDJNW-UHFFFAOYAV