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| CAS No.: | 19889-77-1 |
|---|---|
| Name: | Pipecolamide |
| Article Data: | 27 |
| Molecular Structure: | |
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| Formula: | C6H12N2O |
| Molecular Weight: | 128.174 |
| Synonyms: | Pipecolamide(6CI,8CI);2-Carbamoylpiperidine;MolPort-002-467-271;BB_SC-7848;CID140623;STK929389;AKOS000202860;Piperidine-2-carboxylic acid amide; |
| Density: | 1.06 g/cm3 |
| Melting Point: | 138-140 °C |
| Boiling Point: | 311.747 °C at 760 mmHg |
| Flash Point: | 142.34 °C |
| Risk Codes: | 36/37/38 |
| Safety: | 26-36 |
| PSA: | 55.12000 |
| LogP: | 0.64290 |
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Specification
2-Piperidinecarboxamide is an organic compound with the formula C6H12N2O, and its systematic name is the same with the product name. With the CAS registry number 19889-77-1, it is also named as Piperidine-2-carboxamide. In addition, the molecular weight is 128.17.
Physical properties of 2-Piperidinecarboxamide are: (1)ACD/LogP: -0.32; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.77; (4)ACD/LogD (pH 7.4): -1.06; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 1.00; (8)ACD/KOC (pH 7.4): 2.89; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 55.12 Å2; (13)Index of Refraction: 1.483; (14)Molar Refractivity: 34.514 cm3; (15)Molar Volume: 120.908 cm3; (16)Polarizability: 13.683×10-24cm3; (17)Surface Tension: 38.83 dyne/cm; (18)Density: 1.06 g/cm3; (19)Flash Point: 142.34 °C; (20)Enthalpy of Vaporization: 55.269 kJ/mol; (21)Boiling Point: 311.747 °C at 760 mmHg; (22)Vapour Pressure: 0.001 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(N)C1NCCCC1
(2)Std. InChI: InChI=1S/C6H12N2O/c7-6(9)5-3-1-2-4-8-5/h5,8H,1-4H2,(H2,7,9)
(3)Std. InChIKey: XIMBESZRBTVIOD-UHFFFAOYSA-N