Chemical Properties of val-ser (CAS 13588-94-8)

val-ser

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InChI
InChI=1S/C8H16N2O4/c1-4(2)6(9)7(12)10-5(3-11)8(13)14/h4-6,11H,3,9H2,1-2H3,(H,10,12)(H,13,14)
InChI Key
STTYIMSDIYISRG-UHFFFAOYSA-N
Formula
C8H16N2O4
SMILES
CC(C)C(N)C(=O)NC(CO)C(=O)O
Molecular Weight1
204.22
CAS
13588-94-8
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Physical Properties

Property Value Unit Source
BasG 874.10 kJ/mol NIST
Δf -366.48 kJ/mol Joback Calculated Property
Δfgas -666.65 kJ/mol Joback Calculated Property
Δfus 27.58 kJ/mol Joback Calculated Property
Δvap 96.17 kJ/mol Joback Calculated Property
log10WS 0.09 Crippen Calculated Property
logPoct/wat -1.469 Crippen Calculated Property
McVol 158.420 ml/mol McGowan Calculated Property
Pc 3995.65 kPa Joback Calculated Property
Tboil 795.92 K Joback Calculated Property
Tc 988.60 K Joback Calculated Property
Tfus 492.34 K Joback Calculated Property
Vc 0.580 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [476.06; 519.88] J/mol×K [795.92; 988.60] Show Hide
Cp,gas 476.06 J/mol×K 795.92 Joback Calculated Property
Cp,gas 484.71 J/mol×K 828.03 Joback Calculated Property
Cp,gas 492.79 J/mol×K 860.15 Joback Calculated Property
Cp,gas 500.33 J/mol×K 892.26 Joback Calculated Property
Cp,gas 507.34 J/mol×K 924.37 Joback Calculated Property
Cp,gas 513.85 J/mol×K 956.49 Joback Calculated Property
Cp,gas 519.88 J/mol×K 988.60 Joback Calculated Property

Similar Compounds

N-Serylserine. Val-val, trimethylsilyl ester. lys-val. l-Val-l-leu, trimethylsilyl ester. l-Leucyl-l-valine, trimethylsilyl ester. N-Valylphenylalanine. Thr-Leu, trimethylsilyl ether, trimethylsilyl ester. Val-Val, N-trimethylsilyl-, trimethylsilyl ester. pro-val. N-L-alanyl-L-valine. dl-Alanyl-dl-valine. d-Leucyl-d-leucine, trimethylsilyl ester. L-Ile, N-ethoxycarbonyl, (S)-1-phenylethylamide. D-Ile, N-ethoxycarbonyl, (S)-1-phenylethylamide. L-Val-L-Leu, N-trimethylsilyl-, trimethylsilyl ester.

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Sources

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