Chemical Properties of DL-3-Aminobutanoyl-DL-aminobutanoic acid, N-(2-ethylhexyl)oxycarbonyl-, 2-ethylhexyl ester

DL-3-Aminobutanoyl-DL-aminobutanoic acid, N-(2-ethylhexyl)oxycarbonyl-, 2-ethylhexyl ester

InChI
InChI=1S/C25H48N2O5/c1-7-11-13-21(9-3)17-31-24(29)16-20(6)26-23(28)15-19(5)27-25(30)32-18-22(10-4)14-12-8-2/h19-22H,7-18H2,1-6H3,(H,26,28)(H,27,30)
InChI Key
BMWJKTVNOCIULN-UHFFFAOYSA-N
Formula
C25H48N2O5
SMILES
CCCCC(CC)COC(=O)CC(C)NC(=O)CC(C)NC(=O)OCC(CC)CCCC
Molecular Weight1
456.66
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Physical Properties

Property Value Unit Source
ΔfusH° 66.95 kJ/mol Joback Calculated Property
log10WS -5.10 Relay (1.0) Calculated Property
logPoct/wat 5.362 Crippen Calculated Property
McVol 399.520 ml/mol McGowan Calculated Property
Pc 822.42 kPa Joback Calculated Property
Inp [3121.00; 3121.00]   Show Hide
Inp 3121.00 NIST
Inp 3121.00 NIST
Tboil 639.69 K Relay (1.0) Calculated Property
Tfus 283.24 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1408.86; 1477.17] J/mol×K [1040.49; 1285.96] Show Hide
Cp,gas 1408.86 J/mol×K 1040.49 Joback Calculated Property
Cp,gas 1425.42 J/mol×K 1081.40 Joback Calculated Property
Cp,gas 1439.81 J/mol×K 1122.31 Joback Calculated Property
Cp,gas 1452.10 J/mol×K 1163.23 Joback Calculated Property
Cp,gas 1462.37 J/mol×K 1204.14 Joback Calculated Property
Cp,gas 1470.70 J/mol×K 1245.05 Joback Calculated Property
Cp,gas 1477.17 J/mol×K 1285.96 Joback Calculated Property

Similar Compounds

DL-3-Aminobutanoic acid, N-(2-ethylhexyl)oxycarbonyl-, isobutyl ester. Leu-Trp, N-trimethylsilyl-, trimethylsilyl ester. Zinc octaethylporphyrin chloride. Nalmefene, bis(trifluoroacetate). Formosanan-16-carboxylic acid, 19-methyl-2-oxo-, methyl ester, (19«alpha»)-. Vobassan-17-oic acid, 4-demethyl-3-oxo-, methyl ester. (1'S,3R,4a'S,5a'S,10a'S)-Methyl 1'-methyl-2-oxo-1',4a',5',5a',7',8',10',10a'-octahydrospiro[indoline-3,6'-pyrano[3,4-f]indolizine]-4'-carboxylate. 3'-Deoxyguanosine, tris(trimethylsilyl) deriv.. mexazolam. Cilostazol. Moexipril desethyl - H2O Me (Moexprilate - H2O Me). .delta.1-tetrahydrocannabinolic acid, phenyl-boronate. DL-3-Aminobutanoic acid, N-(2-ethylhexyl)oxycarbonyl-, hexadecyl ester. DL-3-Aminobutanoic acid, N-(2-ethylhexyl)oxycarbonyl-, butyl ester. Galantamin.

Find more compounds similar to DL-3-Aminobutanoyl-DL-aminobutanoic acid, N-(2-ethylhexyl)oxycarbonyl-, 2-ethylhexyl ester.

Sources

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