Chemical Properties of L-Valine, N-(3-methylbut-2-enoyl)-, ethyl ester

L-Valine, N-(3-methylbut-2-enoyl)-, ethyl ester

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InChI
InChI=1S/C12H21NO3/c1-6-16-12(15)11(9(4)5)13-10(14)7-8(2)3/h7,9,11H,6H2,1-5H3,(H,13,14)
InChI Key
TVLWZBOYAZKPOJ-UHFFFAOYSA-N
Formula
C12H21NO3
SMILES
CCOC(=O)C(N=C(O)C=C(C)C)C(C)C
Molecular Weight1
227.30
Sources

Physical Properties

Property Value Unit Source
Δfgas -518.74 kJ/mol Joback Calculated Property
Δvap 70.80 kJ/mol Joback Calculated Property
logPoct/wat 2.50 Crippen Calculated Property
Pc 1959.60 kPa Joback Calculated Property
Tboil 722.15 K Joback Calculated Property
Tc 916.39 K Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
>CH- 2
=C< 2
-N= 1
>C=O (nonring) 1
-OH (alcohol) 1
-CH2- 1
=CH- 1
-CH3 5

Similar Compounds

L-Valine, N-(3-methylbut-2-enoyl)-, pentyl ester. L-Valine, N-(3-methylbut-2-enoyl)-, octyl ester. L-Valine, N-(3-methylbut-2-enoyl)-, undecyl ester. L-Valine, N-(3-methylbut-2-enoyl)-, decyl ester. L-Valine, N-(3-methylbut-2-enoyl)-, dodecyl ester. L-Valine, N-(3-methylbut-2-enoyl)-, nonyl ester. L-Valine, N-(5-chlorovaleryl)-, nonyl ester. L-Valine, N-(3-cyclopentylpropionyl)-, pentyl ester. L-Valine, N-(3-cyclopentylpropionyl)-, isohexyl ester. L-Valine, N-(3-cyclopentylpropionyl)-, pentadecyl ester. L-Valine, N-(3-cyclopentylpropionyl)-, hexyl ester. L-Valine, N-(3-cyclopentylpropionyl)-, dodecyl ester. L-Valine, N-(3-cyclopentylpropionyl)-, undecyl ester. l-Valine, N-caproyl-, methyl ester. L-Valine, N-(3-phenylpropionyl)-, pentyl ester.

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