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64468-77-5

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Basic Information
CAS No.: 64468-77-5
Name: 4-FURAN-2-YL-BENZONITRILE
Article Data: 47
Molecular Structure:
Molecular Structure of 64468-77-5 (4-FURAN-2-YL-BENZONITRILE)
Formula: C11H7NO
Molecular Weight: 169.183
Synonyms: 2-(4-Cyanophenyl)furan;4-(2-Furanyl)benzonitrile;4-(2-Furyl)benzonitrile;
Density: 1.18 g/cm3
Melting Point: 65-66℃
Boiling Point: 301.7 °C at 760 mmHg
Flash Point: 136.3 °C
Hazard Symbols: IrritantXi
PSA: 36.93000
LogP: 2.81828
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Specification

The Benzonitrile,4-(2-furanyl)-, with the CAS registry number 64468-77-5, is also known as Benzonitrile, 4-(2-furanyl)-. This chemical's molecular formula is C11H7NO and molecular weight is 169.1794. Its systematic name is called 4-furan-2-ylbenzonitrile. When you are using this chemical, please be cautious about it, it may cause inflammation to the skin or other mucous membranes.

Physical properties of Benzonitrile,4-(2-furanyl)-: (1)ACD/LogP: 2.49; (2)#H bond acceptors: 2; (3)#H bond donors: 0; (4)#Freely Rotating Bonds: 1; (5)Index of Refraction: 1.596; (6)Molar Refractivity: 48.5 cm3; (7)Molar Volume: 142.5 cm3; (8)Surface Tension: 50.6 dyne/cm; (9)Density: 1.18 g/cm3; (10)Flash Point: 136.3 °C; (11)Enthalpy of Vaporization: 54.19 kJ/mol; (12)Boiling Point: 301.7 °C at 760 mmHg; (13)Vapour Pressure: 0.00104 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: N#Cc2ccc(c1occc1)cc2
(2)InChI: InChI=1/C11H7NO/c12-8-9-3-5-10(6-4-9)11-2-1-7-13-11/h1-7H
(3)InChIKey: ZCUXWFVAKYORDX-UHFFFAOYAW