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CAS No.: | 50606-93-4 |
---|---|
Name: | N-Benzyl-1-Phenylethylamine |
Article Data: | 9 |
Molecular Structure: | |
Formula: | C15H15NO |
Molecular Weight: | 225.29 |
Synonyms: | Acetophenone,2-(benzylamino)- (7CI);2-(Benzylamino)acetophenone;2-Benzylamino-1-phenylethanone;NSC 170271; |
Density: | 1.088 g/cm3 |
Boiling Point: | 365.5 °C at 760 mmHg |
Flash Point: | 139.4 °C |
PSA: | 29.10000 |
LogP: | 3.05000 |
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The Ethanone,1-phenyl-2-[(phenylmethyl)amino]-, with the CAS registry number 50606-93-4, is also known as 2-(Benzylamino)acetophenone. This chemical's molecular formula is C15H15NO and molecular weight is 211.3. What's more, its systematic name is 2-(benzylamino)-1-phenylethanone.
Physical properties of Ethanone,1-phenyl-2-[(phenylmethyl)amino]- are: (1)ACD/LogP: 3.15; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 20.31 Å2; (7)Index of Refraction: 1.581; (8)Molar Refractivity: 68.99 cm3; (9)Molar Volume: 206.9 cm3; (10)Polarizability: 27.35×10-24cm3; (11)Surface Tension: 43.7 dyne/cm; (12)Density: 1.088 g/cm3; (13)Flash Point: 139.4 °C; (14)Enthalpy of Vaporization: 61.18 kJ/mol; (15)Boiling Point: 365.5 °C at 760 mmHg; (16)Vapour Pressure: 1.56E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1ccccc1)CNCc2ccccc2
(2)InChI: InChI=1S/C15H15NO/c17-15(14-9-5-2-6-10-14)12-16-11-13-7-3-1-4-8-13/h1-10,16H,11-12H2
(3)InChIKey: FSZDUBNALDQPEJ-UHFFFAOYSA-N