The Benzonitrile,2-(2-phenylethyl)- is an organic compound with the molecular formula C15H13N. Its CAS registry number is 5505-00-0. Its IUPAC name is 2-(2-Phenylethyl)benzonitrile. What's more, this chemical's molecular weight is 207.27.
Physical properties about this chemical are: (1)ACD/LogP: 4.14; (2)#of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 23.79 Å2; (7)Index of Refraction: 1.591; (8)Molar Refractivity: 65.28 cm3; (9)Molar Volume: 193 cm3; (10)Polarizability: 25.88×10-24 cm3; (11)Surface Tension: 46.9 dyne/cm; (12)Density: 1.07 g/cm3; (13)Flash Point: 146.9 °C; (14)Enthalpy of Vaporization: 55.98 kJ/mol; (15)Boiling Point: 318.3 °C at 760 mmHg ; (16)Vapour Pressure: 0.000364 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1) SMILES: N#Cc1ccccc1CCc2ccccc2
(2) InChI: InChI=1/C15H13N/c16-12-15-9-5-4-8-14(15)11-10-13-6-2-1-3-7-13/h1-9H,10-11H2
(3) InChIKey: OXQILFVQUJWBPI-UHFFFAOYAI
About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia
Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog
©2008 LookChem.com,License: ICP
NO.:Zhejiang16009103
complaints:service@lookchem.com Desktop View