(3R,4R)-Ethyl 4-phenylpiperidine-3-carboxylate supplier

Name
(3R,4R)-Ethyl 4-phenylpiperidine-3-carboxylate
EINECS
CAS No. 749192-64-1
Article Data3
CAS DataBase
Density 1.056 g/cm³
Solubility
Melting Point
Formula C₁₄H₁₉NO₂
Boiling Point 337.6 °C at 760 mmHg
Molecular Weight 233.31
Flash Point 158 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms (3R,4R)-4-Phenyl-piperidine-3-carboxylic acid ethyl ester;3-piperidinecarboxylic acid, 4-phenyl-, ethyl ester, (3R,4R)-;
PSA 38.33000
LogP 2.27160

(3R,4R)-Ethyl 4-phenylpiperidine-3-carboxylate Specification

The CAS register number of (3R,4R)-Ethyl 4-phenylpiperidine-3-carboxylate is 749192-64-1. It also can be called as 3-piperidinecarboxylic acid, 4-phenyl-, ethyl ester, (3R,4R)- and the systematic name about this chemical is ethyl (3R,4R)-4-phenylpiperidine-3-carboxylate. The molecular formula about this chemical is C₁₄H₁₉NO₂ and the molecular weight is 233.309.

Physical properties about (3R,4R)-Ethyl 4-phenylpiperidine-3-carboxylate are: (1)ACD/LogP: 2.57; (2)ACD/LogD (pH 7.4): 0.3; (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): 3.21; (7)#H bond acceptors: 3; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 38.33 Å²; (11)Index of Refraction: 1.513; (12)Molar Refractivity: 66.43 cm³; (13)Molar Volume: 220.7 cm³; (14)Polarizability: 26.33x10^-24cm³; (15)Surface Tension: 36.9 dyne/cm; (16)Density: 1.056 g/cm³; (17)Flash Point: 158 °C; (18)Enthalpy of Vaporization: 58.09 kJ/mol; (19)Boiling Point: 337.6 °C at 760 mmHg; (20)Vapour Pressure: 0.000104 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: CCOC(=O)[C@H]1CNCC[C@H]1c2ccccc2
(2)InChI: InChI=1/C14H19NO2/c1-2-17-14(16)13-10-15-9-8-12(13)11-6-4-3-5-7-11/h3-7,12-13,15H,2,8-10H2,1H3/t12-,13-/m0/s1
(3)InChIKey: KKESSUGZTMZMJU-STQMWFEEBG
(4)Std. InChI: InChI=1S/C14H19NO2/c1-2-17-14(16)13-10-15-9-8-12(13)11-6-4-3-5-7-11/h3-7,12-13,15H,2,8-10H2,1H3/t12-,13-/m0/s1
(5)Std. InChIKey: KKESSUGZTMZMJU-STQMWFEESA-N

Product Name

(3R,4R)-Ethyl 4-phenylpiperidine-3-carboxylate

(3R,4R)-Ethyl 4-phenylpiperidine-3-carboxylate Specification

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