Chemical Properties of (+)-Jasmonic acid - (S)-Ile conjugate, methyl ester

(+)-Jasmonic acid - (S)-Ile conjugate, methyl ester

InChI
InChI=1S/C19H31NO4/c1-5-7-8-9-15-14(10-11-16(15)21)12-17(22)20-18(13(3)6-2)19(23)24-4/h7-8,13-15,18H,5-6,9-12H2,1-4H3,(H,20,22)/b8-7-/t13?,14-,15+,18?/m1/s1
InChI Key
YAGOAONRDWKQSK-JYAUPMHQSA-N
Formula
C19H31NO4
SMILES
CC/C=C\C[C@@H]1C(=O)CC[C@@H]1CC(=O)NC(C(=O)OC)C(C)CC
Molecular Weight1
337.46
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Physical Properties

Property Value Unit Source
ΔfusH° 42.12 kJ/mol Joback Calculated Property
logPoct/wat 3.032 Crippen Calculated Property
McVol 283.970 ml/mol McGowan Calculated Property
Inp [2378.00; 2378.00]   Show Hide
Inp 2378.00 NIST
Inp 2378.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [948.27; 1026.85] J/mol×K [896.16; 1109.88] Show Hide
Cp,gas 948.27 J/mol×K 896.16 Joback Calculated Property
Cp,gas 964.81 J/mol×K 931.78 Joback Calculated Property
Cp,gas 979.93 J/mol×K 967.40 Joback Calculated Property
Cp,gas 993.68 J/mol×K 1003.02 Joback Calculated Property
Cp,gas 1006.06 J/mol×K 1038.64 Joback Calculated Property
Cp,gas 1017.11 J/mol×K 1074.26 Joback Calculated Property
Cp,gas 1026.85 J/mol×K 1109.88 Joback Calculated Property

Similar Compounds

(-)-Jasmonic acid - (S)-Ile conjugate, methyl ester. (-)-Jasmonic acid, Ile-conjugate # 3, methyl ester. (-)-Jasmonic acid, Ile-conjugate # 1, methyl ester. cis-Jasmonic acid, Ile-conjugate, methyl ester. (-)-Jasmonic acid, Ile-conjugate # 2, methyl ester. Homojasmonic acid, Ile conjugate, methyl ester. Dehydrojasmonic acid, Ile conjugate, methyl ester. bis-Homojasmonic acid, Ile conjugate, methyl ester. (-)-Jasmonic acid - (R)-Val conjugate, methyl ester. (-) Jasmonic acid - (S)-Val conjugate, methyl ester. (+)-Jasmonic acid - (S)-Val conjugate, methyl ester. (-)-Jasmonic acid - (S)-Leu conjugate, methyl ester. (-)-Jasmonic acid, - (S)-Glu conjugate, methyl ester. (-)-Jasmonic acid, (S)-Asp conjugate, methyl ester. (-)-Jasmonic acid, - (S)-Phe conjugate, methyl ester.

Find more compounds similar to (+)-Jasmonic acid - (S)-Ile conjugate, methyl ester.

Sources

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