5265-18-9

The 1-Propanone,2-amino-1-phenyl-, with the CAS registry number 5265-18-9, is also known as (S)-2-Amino-1-phenyl-1-propanone. This chemical's molecular formula is C₉H₁₁NO and molecular weight is 149.19. What's more, its systematic name is (2S)-2-Amino-1-phenylpropan-1-one. Its classification codes are: (1)Central Nervous System Agents; (2)Central Nervous System Stimulants; (3)Psychotropic Drugs.

Physical properties of 1-Propanone,2-amino-1-phenyl- are: (1)ACD/LogP: 1.16; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.22; (4)ACD/LogD (pH 7.4): 0.49; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 21.79; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 20.31 Å²; (13)Index of Refraction: 1.54; (14)Molar Refractivity: 44.4 cm³; (15)Molar Volume: 141.5 cm³; (16)Polarizability: 17.6×10^-24 cm³; (17)Surface Tension: 41.2 dyne/cm; (18)Density: 1.054 g/cm³; (19)Flash Point: 108 °C; (20)Enthalpy of Vaporization: 49.25 kJ/mol; (21)Boiling Point: 255 °C at 760 mmHg; (22)Vapour Pressure: 0.0167 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1ccccc1)[C@@H](N)C
(2)InChI: InChI=1/C9H11NO/c1-7(10)9(11)8-5-3-2-4-6-8/h2-7H,10H2,1H3/t7-/m0/s1
(3)InChIKey: PUAQLLVFLMYYJJ-ZETCQYMHBN