Molecular Structure of Ethyl 1-benzylpiperidine-4-carboxylate (CAS NO.24228-40-8):
IUPAC Name: Ethyl 1-benzylpiperidine-4-carboxylate
Empirical Formula: C15H21NO2
Molecular Weight: 247.3327
H bond acceptors: 3
H bond donors: 0
Freely Rotating Bonds: 5
Polar Surface Area: 29.54 Å2
Index of Refraction: 1.533
Molar Refractivity: 71.37 cm3
Molar Volume: 229.9 cm3
Surface Tension: 41.7 dyne/cm
Density: 1.075 g/cm3
Flash Point: 110.7 °C
Enthalpy of Vaporization: 56.93 kJ/mol
Boiling Point: 327 °C at 760 mmHg
Vapour Pressure: 0.000208 mmHg at 25 °C
EINECS: 246-094-9
Product Categories: Piperidine; Heterocyclic Compounds; Aromatics; Heterocycles
InChI: InChI=1/C15H21NO2/c1-2-18-15(17)14-8-10-16(11-9-14)12-13-6-4-3-5-7-13/h3-7,14H,2,8-12H2,1H3
Smiles: C(C1CCN(CC1)Cc1ccccc1)(=O)OCC
Hazard Codes: Xi
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 24/25
S24/25:Avoid contact with skin and eyes.
Hazard Note: Irritant
Ethyl 1-benzylpiperidine-4-carboxylate , with CAS number of 24228-40-8, can be called 4-piperidinecarboxylic acid, 1-(phenylmethyl)-, ethyl ester ; Ethyl 1-benzylpiperidine-4-carboxylate ; Ethyl 1-benzylisonipecotate ; Ethyl 1-benzylpiperidine-4-carboxylate 96% ; N-Benzyl-4-carboethoxypiperidine . It is a kind of colourless oil.
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