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Name	Benzonitrile,2-(2-phenylethyl)-	EINECS	N/A
CAS No.	5505-00-0	Density	1.07 g/cm³
PSA	23.79000	LogP	3.34348
Solubility	N/A	Melting Point	N/A
Formula	C₁₅H₁₃N	Boiling Point	318.3 °C at 760 mmHg
Molecular Weight	207.275	Flash Point	146.9 °C
Transport Information	N/A	Appearance	N/A
Safety		Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	Benzonitrile,o-phenethyl- (7CI,8CI);2-(2-Phenylethyl)benzonitrile;2-Phenethylbenzonitrile;NSC 100687;o-Phenethylbenzonitrile;	Article Data	8

Benzonitrile,2-(2-phenylethyl)- Specification

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^-24cm³; (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

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