Chemical Properties of L-Valine, N-(3-phenylpropionyl)-, pentyl ester

L-Valine, N-(3-phenylpropionyl)-, pentyl ester

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InChI
InChI=1S/C19H29NO3/c1-4-5-9-14-23-19(22)18(15(2)3)20-17(21)13-12-16-10-7-6-8-11-16/h6-8,10-11,15,18H,4-5,9,12-14H2,1-3H3,(H,20,21)
InChI Key
QMXKQAMCSADTHI-UHFFFAOYSA-N
Formula
C19H29NO3
SMILES
CCCCCOC(=O)C(N=C(O)CCc1ccccc1)C(C)C
Molecular Weight1
319.44
Sources

Physical Properties

Property Value Unit Source
Δfgas -534.12 kJ/mol Joback Calculated Property
Δvap 88.62 kJ/mol Joback Calculated Property
logPoct/wat 4.33 Crippen Calculated Property
Pc 1416.50 kPa Joback Calculated Property
Tboil 904.95 K Joback Calculated Property
Tc 1115.11 K Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 2
-O- (nonring) 1
=C< 1
-N= 1
=CH- (ring) 5
-OH (alcohol) 1
=C< (ring) 1
>C=O (nonring) 1
-CH2- 6
-CH3 3

Similar Compounds

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

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