Chemical Properties of D-Norval, N-ethoxycarbonyl, (S)-1-phenylethylamide

D-Norval, N-ethoxycarbonyl, (S)-1-phenylethylamide

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InChI
InChI=1S/C16H24N2O3/c1-4-9-14(18-16(20)21-5-2)15(19)17-12(3)13-10-7-6-8-11-13/h6-8,10-12,14H,4-5,9H2,1-3H3,(H,17,19)(H,18,20)/t12-,14+/m0/s1
InChI Key
ZNDAJFRHIWRDFF-GXTWGEPZSA-N
Formula
C16H24N2O3
SMILES
CCCC(NC(=O)OCC)C(=O)NC(C)c1ccccc1
Molecular Weight1
292.37
Sources

Physical Properties

Property Value Unit Source
Δf 7.31 kJ/mol Joback Calculated Property
Δfgas -398.04 kJ/mol Joback Calculated Property
Δfus 38.77 kJ/mol Joback Calculated Property
Δvap 81.48 kJ/mol Joback Calculated Property
logPoct/wat 2.779 Crippen Calculated Property
Pc 1937.24 kPa Joback Calculated Property
Tboil 821.78 K Joback Calculated Property
Tc 1032.15 K Joback Calculated Property
Tfus 493.91 K Joback Calculated Property
Vc 0.911 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 735.00 J/mol×K 821.78 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 2
-O- (nonring) 1
-CH3 3
=CH- (ring) 5
=C< (ring) 1
-CH2- 3
>NH 2
>C=O (nonring) 2

Similar Compounds

L-Norval, N-ethoxycarbonyl, (S)-1-phenylethylamide. D-Norleu, N-ethoxycarbonyl, (S)-1-phenylethylamide. L-Norleu, N-ethoxycarbonyl, (S)-1-phenylethylamide. D-Leu, N-ethoxycarbonyl, (S)-1-phenylethylamide. L-Leu, N-ethoxycarbonyl, (S)-1-phenylethylamide. L-«alpha»-Aminobutyric acid, N-ethoxycarbonyl, (S)-1-phenylethylamide. D-«alpha»-Aminobutyric acid, N-ethoxycarbonyl, (S)-1-phenylethylamide. L-Ile, N-ethoxycarbonyl, (S)-1-phenylethylamide. D-Ile, N-ethoxycarbonyl, (S)-1-phenylethylamide. D-Val, N-ethoxycarbonyl, (S)-1-phenylethylamide. L-Val, N-ethoxycarbonyl, (S)-1-phenylethylamide. D-Ala, N-ethoxycarbonyl, (S)-1-phenylethylamide. L-Ala, N-ethoxycarbonyl, (S)-1-phenylethylamide. L-Pro, N-ethoxycarbonyl, (S)-1-phenylethylamide. D-Pro, N-ethoxycarbonyl, (S)-1-phenylethylamide.

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