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

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

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InChI
InChI=1S/C22H41NO3/c1-6-7-8-9-10-11-12-13-14-15-16-26-22(25)21(19(4)5)23-20(24)17-18(2)3/h17,19,21H,6-16H2,1-5H3,(H,23,24)
InChI Key
CBGUICXNMXZJRC-UHFFFAOYSA-N
Formula
C22H41NO3
SMILES
CCCCCCCCCCCCOC(=O)C(N=C(O)C=C(C)C)C(C)C
Molecular Weight1
367.57
Sources

Physical Properties

Property Value Unit Source
Δfgas -725.14 kJ/mol Joback Calculated Property
Δvap 93.06 kJ/mol Joback Calculated Property
logPoct/wat 6.40 Crippen Calculated Property
Pc 965.07 kPa Joback Calculated Property
Tboil 950.95 K Joback Calculated Property
Tc 1164.77 K Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
>CH- 2
-CH3 5
-N= 1
-OH (alcohol) 1
-CH2- 11
=C< 2
=CH- 1
>C=O (nonring) 1

Similar Compounds

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

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