Basic information
- Name:
trans-3-Ethoxycarbonyl-4-(4-flurophenyl)-N-methyl piperdine-2,6-dione
- CAS No.:
109887-52-7
- Molecular Structure:
- Formula:
- C15H16FNO4
- Molecular Weight:
- 293.29
- Synonyms:
- 3-piperidinecarboxylic acid, 4-(4-fluorophenyl)-1-methyl-2,6-dioxo-, ethyl ester, (3R,4S)-;3-Piperidinecarboxylic acid, 4-(4-fluorophenyl)-1-methyl-2,6-dioxo-, ethylester, trans-;
- Density:
- 1.258 g/cm3
- Boiling Point:
- 424.9 °C at 760 mmHg
- Flash Point:
- 210.7 °C
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Chemistry
Molecular Structure of trans-3-Ethoxycarbonyl-4-(4-flurophenyl)-N-methyl piperdine-2,6-dione (CAS NO.109887-52-7):
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Empirical Formula: C15H16FNO4
Molecular Weight: 293.2902
H bond acceptors: 5
H bond donors: 0
Freely Rotating Bonds: 4
Polar Surface Area: 63.68Å2
Index of Refraction: 1.526
Molar Refractivity: 71.61 cm3
Molar Volume: 233 cm3
Surface Tension: 44 dyne/cm
Density: 1.258 g/cm3
Flash Point: 210.7 °C
Enthalpy of Vaporization: 67.94 kJ/mol
Boiling Point: 424.9 °C at 760 mmHg
Vapour Pressure: 2E-07 mmHg at 25°C
SMILES: O=C2C[C@H](c1ccc(F)cc1)[C@H](C(=O)N2C)C(=O)OCC
InChI: InChI=1/C15H16FNO4/c1-3-21-15(20)13-11(8-12(18)17(2)14(13)19)9-4-6-10(16)7-5-9/h4-7,11,13H,3,8H2,1-2H3/t11-,13-/m1/s1
Specification
trans-3-Ethoxycarbonyl-4-(4-flurophenyl)-N-methyl piperdine-2,6-dione , with CAS number of 109887-52-7, can be called 3-Piperidinecarboxylic acid, 4-(4-fluorophenyl)-1-methyl-2,6-dioxo-, ethylester, trans- ; 3-piperidinecarboxylic acid, 4-(4-fluorophenyl)-1-methyl-2,6-dioxo-, ethyl ester, (3R,4S)- .