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| CAS No.: | 7492-88-8 |
|---|---|
| Name: | 3-Piperidinecarbonitrile |
| Molecular Structure: | |
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| Formula: | C6H10N2 |
| Molecular Weight: | 110.159 |
| Synonyms: | Nipecotonitrile(8CI);3-Cyanopiperidine; |
| Density: | 0.98 g/cm3 |
| Boiling Point: | 226.4 °C at 760 mmHg |
| Flash Point: | 90.7 °C |
| PSA: | 35.82000 |
| LogP: | 0.83838 |
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Specification
The 3-Piperidinecarbonitrile is an organic compound with the formula C6H10N2. The systematic name of this chemical is piperidine-3-carbonitrile. With the CAS registry number 7492-88-8, it is also named as 3-Cyanopiperidine.
Physical properties about 3-Piperidinecarbonitrile are: (1)ACD/LogP: -0.20; (2)#H bond acceptors: 2; (3)#H bond donors: 1; (4)Polar Surface Area: 27.03 ?2; (5)Index of Refraction: 1.475; (6)Molar Refractivity: 31.35 cm3; (7)Molar Volume: 111.2 cm3; (8)Polarizability: 12.42×10-24cm3; (9)Surface Tension: 37.9 dyne/cm; (10)Density: 0.98 g/cm3; (11)Flash Point: 90.7 °C; (12)Enthalpy of Vaporization: 46.29 kJ/mol; (13)Boiling Point: 226.4 °C at 760 mmHg; (14)Vapour Pressure: 0.082 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: N#CC1CCCNC1
(2)InChI: InChI=1/C6H10N2/c7-4-6-2-1-3-8-5-6/h6,8H,1-3,5H2
(3)InChIKey: ZGNXATVKGIJQGC-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C6H10N2/c7-4-6-2-1-3-8-5-6/h6,8H,1-3,5H2
(5)Std. InChIKey: ZGNXATVKGIJQGC-UHFFFAOYSA-N