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2-Cyanovaleraldehyde

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Name

2-Cyanovaleraldehyde

EINECS N/A
CAS No. 63744-92-3 Density 0.937 g/cm3
PSA 40.86000 LogP 1.12518
Solubility N/A Melting Point N/A
Formula C6H9NO Boiling Point 182.525 °C at 760 mmHg
Molecular Weight 111.1418 Flash Point 64.189 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 63744-92-3 (2-formylpentanenitrile) Hazard Symbols N/A
Synonyms

2-formylpentanenitrile;

 

2-Cyanovaleraldehyde Specification

The Pentanenitrile, 2-formyl- is an organic compound with the formula C6H9NO. With the CAS registry number 63744-92-3, its systematic name is 2-formylpentanenitrile.

Physical properties of 2-formylpentanenitrile: (1)ACD/LogP: 0.59; (2)#H bond acceptors: 2; (3)#Freely Rotating Bonds: 3; (4)Index of Refraction: 1.418; (5)Molar Refractivity: 29.905 cm3; (6)Molar Volume: 118.654 cm3; (7)Surface Tension: 33.482 dyne/cm; (8)Density: 0.937 g/cm3; (9)Flash Point: 64.189 °C; (10)Enthalpy of Vaporization: 41.877 kJ/mol; (11)Boiling Point: 182.525 °C at 760 mmHg; (12)Vapour Pressure: 0.807 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: N#CC(CCC)C=O
(2)InChI: InChI=1/C6H9NO/c1-2-3-6(4-7)5-8/h5-6H,2-3H2,1H3
(3)InChIKey: VUXYPZAXIFRMQU-UHFFFAOYAU

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