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CAS No.: | 26614-98-2 |
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Name: | 4-(2-P-Tolyl-ethyl)-piperidine |
Molecular Structure: | |
Formula: | C14H21N |
Molecular Weight: | 203.32 |
Synonyms: | 4-[2-(4-Methylphenyl)ethyl]piperidine; |
Density: | 0.936 g/cm3 |
Boiling Point: | 308.7 °C at 760 mmHg |
Flash Point: | 142.6 °C |
PSA: | 12.03000 |
LogP: | 3.25600 |
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The CAS register number of 4-(2-P-Tolyl-ethyl)-piperidine is 26614-98-2. The IUPAC name about this chemical is 4-[2-(4-methylphenyl)ethyl]piperidine. The molecular formula about this chemical is C14H21N and the molecular weight is 203.32.
Physical properties about 4-(2-P-Tolyl-ethyl)-piperidine are: (1)ACD/LogP: 3.81; (2)ACD/LogD (pH 5.5): 0.71; (3)ACD/LogD (pH 7.4): 0.79; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 2.23; (7)ACD/KOC (pH 7.4): 2.67; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 3.24 Å2; (12)Index of Refraction: 1.511; (13)Molar Refractivity: 65.04 cm3; (14)Molar Volume: 217 cm3; (15)Polarizability: 25.78x10-24cm3; (16)Surface Tension: 34.7 dyne/cm; (17)Density: 0.936 g/cm3; (18)Flash Point: 142.6 °C; (19)Enthalpy of Vaporization: 54.94 kJ/mol; (20)Boiling Point: 308.7 °C at 760 mmHg; (21)Vapour Pressure: 0.000671 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: c1(ccc(cc1)C)CCC2CCNCC2
(2)InChI: InChI=1/C14H21N/c1-12-2-4-13(5-3-12)6-7-14-8-10-15-11-9-14/h2-5,14-15H,6-11H2,1H3
(3)InChIKey: UAMOWMWECFNJHB-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C14H21N/c1-12-2-4-13(5-3-12)6-7-14-8-10-15-11-9-14/h2-5,14-15H,6-11H2,1H3
(5)Std. InChIKey: UAMOWMWECFNJHB-UHFFFAOYSA-N