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CAS No.: | 56528-77-9 |
---|---|
Name: | 2-cyclohexylpiperidine |
Article Data: | 16 |
Molecular Structure: | |
Formula: | C11H21N |
Molecular Weight: | 167.294 |
Synonyms: | (?à)-2-Cyclohexylpiperidine;2-Cyclohexylpiperidine; |
EINECS: | 260-246-1 |
Density: | 0.916g/cm3 |
Boiling Point: | 248.8 °C at 760 mmHg |
Flash Point: | 102.2 °C |
PSA: | 12.03000 |
LogP: | 3.03760 |
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The Piperidine,2-cyclohexyl-, with CAS registry number 56528-77-9, has the systematic name of 2-cyclohexylpiperidine. Its molecular weight is 167.29114. And the chemical formula of this chemical is C11H21N. What's more, its EINECS is 260-246-1.
Physical properties of Piperidine,2-cyclohexyl-: (1)ACD/LogP: 3.48; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.38; (4)ACD/LogD (pH 7.4): 0.46; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1.49; (8)ACD/KOC (pH 7.4): 1.76; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 3.24 Å2; (13)Index of Refraction: 1.482; (14)Molar Refractivity: 52.12 cm3; (15)Molar Volume: 182.5 cm3; (16)Polarizability: 20.66×10-24cm3; (17)Surface Tension: 33.5 dyne/cm; (18)Density: 0.916 g/cm3; (19)Flash Point: 102.2 °C; (20)Enthalpy of Vaporization: 48.6 kJ/mol; (21)Boiling Point: 248.8 °C at 760 mmHg; (22)Vapour Pressure: 0.0237 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: N2C(C1CCCCC1)CCCC2
(2)InChI: InChI=1/C11H21N/c1-2-6-10(7-3-1)11-8-4-5-9-12-11/h10-12H,1-9H2
(3)InChIKey: DNXQKSGKSCAEIY-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C11H21N/c1-2-6-10(7-3-1)11-8-4-5-9-12-11/h10-12H,1-9H2
(5)Std. InChIKey: DNXQKSGKSCAEIY-UHFFFAOYSA-N