Chemical Properties of L-valine, n-acetyl- (CAS 96-81-1)

L-valine, n-acetyl-

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InChI
InChI=1S/C7H13NO3/c1-4(2)6(7(10)11)8-5(3)9/h4,6H,1-3H3,(H,8,9)(H,10,11)
InChI Key
IHYJTAOFMMMOPX-UHFFFAOYSA-N
Formula
C7H13NO3
SMILES
CC(=O)NC(C(=O)O)C(C)C
Molecular Weight1
159.18
CAS
96-81-1
Other Names
  • Acetylvaline
  • N-Acetyl-L-valine
  • N-Acetylvaline
  • Valine, N-acetyl-, L-
Sources

Physical Properties

Property Value Unit Source
Δf -302.09 kJ/mol Joback Calculated Property
Δfgas -522.29 kJ/mol Joback Calculated Property
Δfus 19.23 kJ/mol Joback Calculated Property
Δvap 67.01 kJ/mol Joback Calculated Property
logPoct/wat 0.232 Crippen Calculated Property
Pc 3704.46 kPa Joback Calculated Property
Tboil 608.77 K Joback Calculated Property
Tc 795.87 K Joback Calculated Property
Tfus 351.99 K Joback Calculated Property
Vc 0.481 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 325.77 J/mol×K 608.77 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 2
-OH (alcohol) 1
-CH3 3
>NH 1
>C=O (nonring) 2

Similar Compounds

L-Valine, N-glycyl-. N-Glycyl-dl-valine. Dl-valine, n-acetyl-, methyl ester. N-L-alanyl-L-valine. dl-Alanyl-dl-valine. L-leucine, n-acetyl-. L-valine, n-butyryl-, methyl ester. L-methionine, n-acetyl-. N-acetyl-l-glutamic acid. L-valine, n-capryloyl-, methyl ester. L-leucine, n-glycyl-. lys-val. DL-Proline, 5-oxo-. L-Pyroglutamic acid. L-Alanine, N-acetyl-.

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