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N-(4-Chlorophenyl)piperidine-4-carboxamide

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Name

N-(4-Chlorophenyl)piperidine-4-carboxamide

EINECS N/A
CAS No. 735258-48-7 Density 1.236 g/cm3
PSA 41.13000 LogP 2.67990
Solubility N/A Melting Point N/A
Formula C12H15ClN2O Boiling Point 435.7 °C at 760 mmHg
Molecular Weight 238.71 Flash Point 217.3 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 735258-48-7 (PIPERIDINE-4-CARBOXYLIC ACID (4-CHLORO-PHENYL)-AMIDE) Hazard Symbols N/A
Synonyms

Piperidine-4-carboxylic acid (4-chlorophenyl)amide

 

N-(4-Chlorophenyl)piperidine-4-carboxamide Specification

The N-(4-Chlorophenyl)piperidine-4-carboxamide, with CAS registry number 735258-48-7, has the systematic name of N-(4-chlorophenyl)piperidine-4-carboxamide. And the chemical formula of this chemical is C12H15ClN2O. Its molecular weight is 238.72.

Physical properties about this chemical are: (1)ACD/LogP: 2.25; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 3; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 41.13 Å2; (11)Index of Refraction: 1.589; (12)Molar Refractivity: 65.05 cm3; (13)Molar Volume: 193 cm3; (14)Polarizability: 25.78×10-24cm3; (15)Surface Tension: 49.2 dyne/cm; (16)Enthalpy of Vaporization: 69.2 kJ/mol; (17)Vapour Pressure: 8.57E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Nc1ccc(Cl)cc1)C2CCNCC2
(2)InChI: InChI=1/C12H15ClN2O/c13-10-1-3-11(4-2-10)15-12(16)9-5-7-14-8-6-9/h1-4,9,14H,5-8H2,(H,15,16)
(3)InChIKey: BWHUGLBSNCRSPC-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C12H15ClN2O/c13-10-1-3-11(4-2-10)15-12(16)9-5-7-14-8-6-9/h1-4,9,14H,5-8H2,(H,15,16)
(5)Std. InChIKey: BWHUGLBSNCRSPC-UHFFFAOYSA-N

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