Chemical Properties of L-Valine, N-(4-methylbenzoyl)-, isohexyl ester

L-Valine, N-(4-methylbenzoyl)-, isohexyl ester

InChI
InChI=1S/C19H29NO3/c1-13(2)7-6-12-23-19(22)17(14(3)4)20-18(21)16-10-8-15(5)9-11-16/h8-11,13-14,17H,6-7,12H2,1-5H3,(H,20,21)
InChI Key
MNPSLAIKQFGFJW-UHFFFAOYSA-N
Formula
C19H29NO3
SMILES
Cc1ccc(C(=O)NC(C(=O)OCCCC(C)C)C(C)C)cc1
Molecular Weight1
319.44
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Physical Properties

Property Value Unit Source
ΔfusH° 39.12 kJ/mol Joback Calculated Property
logPoct/wat 3.729 Crippen Calculated Property
McVol 273.800 ml/mol McGowan Calculated Property
Inp [2351.00; 2351.00]   Show Hide
Inp 2351.00 NIST
Inp 2351.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [386.34; 913.62] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-7.47700e+00
Coefficient B1.68160e+00
Coefficient C-9.18860e-04
Coefficient D1.58360e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 386.34 J/mol×K 273.00 Calculated Property
Cp,gas 479.44 J/mol×K 353.78 Calculated Property
Cp,gas 562.75 J/mol×K 434.56 Calculated Property
Cp,gas 636.76 J/mol×K 515.33 Calculated Property
Cp,gas 701.97 J/mol×K 596.11 Calculated Property
Cp,gas 758.89 J/mol×K 676.89 Calculated Property
Cp,gas 808.01 J/mol×K 757.67 Calculated Property
Cp,gas 849.84 J/mol×K 838.44 Calculated Property
Cp,gas 884.88 J/mol×K 919.22 Calculated Property
Cp,gas 913.62 J/mol×K 1000.00 Calculated Property

Similar Compounds

L-Valine, N-(4-methylbenzoyl)-, pentyl ester. L-Valine, N-(4-methylbenzoyl)-, tetradecyl ester. L-Valine, N-(4-methylbenzoyl)-, hexadecyl ester. L-Valine, N-(4-methylbenzoyl)-, dodecyl ester. L-Valine, N-(4-methylbenzoyl)-, undecyl ester. L-Valine, N-(4-methylbenzoyl)-, pentadecyl ester. L-Valine, N-(4-methylbenzoyl)-, heptadecyl ester. L-Valine, N-(4-methylbenzoyl)-, hexyl ester. L-Valine, N-(4-methylbenzoyl)-, butyl ester. L-Valine, N-(4-methylbenzoyl)-, propyl ester. L-Valine, N-(4-ethylbenzoyl)-, pentyl ester. L-Valine, N-(3-methylbenzoyl)-, dodecyl ester. L-Valine, N-(3-methylbenzoyl)-, undecyl ester. L-Valine, N-(4-methylbenzoyl)-, isobutyl ester. L-Valine, N-(3-trifluoromethylbenzoyl)-, isohexyl ester.

Find more compounds similar to L-Valine, N-(4-methylbenzoyl)-, isohexyl ester.

Sources

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