Chemical Properties of DL-Alanyl-DL-alanyl-DL-alanine, N,N',N''-trimethyl-N'''-hexyloxycarbonyl-, hexyl ester

DL-Alanyl-DL-alanyl-DL-alanine, N,N',N''-trimethyl-N'''-hexyloxycarbonyl-, hexyl ester

InChI
InChI=1S/C25H47N3O6/c1-9-11-13-15-17-33-24(31)21(5)27(7)22(29)19(3)26(6)23(30)20(4)28(8)25(32)34-18-16-14-12-10-2/h19-21H,9-18H2,1-8H3
InChI Key
MXWYSIJQYICTQA-UHFFFAOYSA-N
Formula
C25H47N3O6
SMILES
CCCCCCOC(=O)C(C)N(C)C(=O)C(C)N(C)C(=O)C(C)N(C)C(=O)OCCCCCC
Molecular Weight1
485.67
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Physical Properties

Property Value Unit Source
ΔfH°gas -1353.00 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 70.94 kJ/mol Joback Calculated Property
ΔvapH° 117.22 kJ/mol Relay (1.0) Calculated Property
log10WS -3.66 Relay (1.0) Calculated Property
logPoct/wat 3.841 Crippen Calculated Property
McVol 411.070 ml/mol McGowan Calculated Property
Pc 833.38 kPa Joback Calculated Property
Inp [3009.00; 3009.00]   Show Hide
Inp 3009.00 NIST
Inp 3009.00 NIST
Tboil 642.85 K Relay (1.0) Calculated Property
Tc 882.25 K Relay (1.0) Calculated Property
Tfus 325.34 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, 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 [1433.75; 1507.46] J/mol×K [1031.78; 1276.24] Show Hide
Cp,gas 1433.75 J/mol×K 1031.78 Joback Calculated Property
Cp,gas 1450.70 J/mol×K 1072.52 Joback Calculated Property
Cp,gas 1465.64 J/mol×K 1113.27 Joback Calculated Property
Cp,gas 1478.68 J/mol×K 1154.01 Joback Calculated Property
Cp,gas 1489.93 J/mol×K 1194.75 Joback Calculated Property
Cp,gas 1499.48 J/mol×K 1235.50 Joback Calculated Property
Cp,gas 1507.46 J/mol×K 1276.24 Joback Calculated Property

Similar Compounds

DL-Alanyl-DL-alanyl-DL-alanine, N,N',N''-trimethyl-N''-octyloxycarbonyl-, octyl ester. DL-Alanyl-DL-alanine, N,N'-dimethyl-N'-hexyloxycarbonyl-, hexyl ester. DL-Alanyl-DL-alanine, N,N'-dimethyl-N'-octyloxycarbonyl-, octyl ester. DL-Alanyl-DL-alanine, N,N'-dimethyl-N'-(byt-4-en-1-yloxycarbonyl)-, hexyl ester. DL-Alanyl-DL-alanine, N,N'-dimethyl-N'-(3-chloropropoxycarbonyl)-, heptyl ester. DL-Alanyl-DL-alanine, N,N'-dimethyl-N'-(3-chloropropoxycarbonyl)-, nonyl ester. DL-Alanyl-DL-alanine, N,N'-dimethyl-N'-(3-chloropropoxycarbonyl)-, octyl ester. DL-Alanyl-DL-alanine, N,N'-dimethyl-N'-(byt-4-en-1-yloxycarbonyl)-, tetradecyl ester. DL-Alanyl-DL-alanine, N,N'-dimethyl-N'-(byt-4-en-1-yloxycarbonyl)-, heptyl ester. DL-Alanyl-DL-alanine, N,N'-dimethyl-N'-(byt-4-en-1-yloxycarbonyl)-, octyl ester. DL-Alanyl-DL-alanine, N,N'-dimethyl-N'-(byt-4-en-1-yloxycarbonyl)-, pentyl ester. DL-Alanyl-DL-alanyl-DL-alanine, N,N',N''-trimethyl-N''-(2-ethylhexyloxycarbonyl)-, 2-ethylhexyl ester. DL-Alanyl-DL-alanine, N,N'-dimethyl-N'-(2-ethylhexyloxycarbonyl)-, 2-ethylhexyl ester. DL-Alanyl-DL-alanine, N,N'-dimethyl-N'-(byt-4-en-1-yloxycarbonyl)-, byt-4-en-1-yl ester. DL-Valyl-DL-valine, N-methyl-N-hexyloxycarbonyl-, hexyl ester.

Find more compounds similar to DL-Alanyl-DL-alanyl-DL-alanine, N,N',N''-trimethyl-N'''-hexyloxycarbonyl-, hexyl ester.

Sources

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