Chemical Properties of DL-Alanyl-DL-alanyl-DL-alanine, N,N',N''-trimethyl-N''-(2-ethylhexyloxycarbonyl)-, 2-ethylhexyl ester

DL-Alanyl-DL-alanyl-DL-alanine, N,N',N''-trimethyl-N''-(2-ethylhexyloxycarbonyl)-, 2-ethylhexyl ester

InChI
InChI=1S/C29H55N3O6/c1-11-15-17-24(13-3)19-37-28(35)23(7)31(9)26(33)21(5)30(8)27(34)22(6)32(10)29(36)38-20-25(14-4)18-16-12-2/h21-25H,11-20H2,1-10H3
InChI Key
LNMUCUBIAKPLPK-UHFFFAOYSA-N
Formula
C29H55N3O6
SMILES
CCCCC(CC)COC(=O)C(C)N(C)C(=O)C(C)N(C)C(=O)C(C)N(C)C(=O)OCC(CC)CCCC
Molecular Weight1
541.76
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Physical Properties

Property Value Unit Source
ω 1.2038 Relay (1.0) Calculated Property
ΔfG° -212.24 kJ/mol Joback Calculated Property
ΔfH°gas -1470.95 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 71.09 kJ/mol Joback Calculated Property
ΔvapH° 126.19 kJ/mol Relay (1.0) Calculated Property
IE 8.13 eV Relay (1.0) Calculated Property
log10WS -4.72 Relay (1.0) Calculated Property
logPoct/wat 5.113 Crippen Calculated Property
McVol 467.430 ml/mol McGowan Calculated Property
Pc 711.11 kPa Joback Calculated Property
Inp [3230.00; 3230.00]   Show Hide
Inp 3230.00 NIST
Inp 3230.00 NIST
Tboil 672.20 K Relay (1.0) Calculated Property
Tc 901.31 K Relay (1.0) Calculated Property
Tfus 305.73 K Relay (1.0) Calculated Property
Vc 1.695 m3/kmol Relay (1.0) Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1702.54; 1776.56] J/mol×K [1158.36; 1467.55] Show Hide
Cp,gas 1702.54 J/mol×K 1158.36 Joback Calculated Property
Cp,gas 1721.09 J/mol×K 1209.89 Joback Calculated Property
Cp,gas 1736.83 J/mol×K 1261.42 Joback Calculated Property
Cp,gas 1750.01 J/mol×K 1312.95 Joback Calculated Property
Cp,gas 1760.85 J/mol×K 1364.49 Joback Calculated Property
Cp,gas 1769.62 J/mol×K 1416.02 Joback Calculated Property
Cp,gas 1776.56 J/mol×K 1467.55 Joback Calculated Property

Similar Compounds

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

Find more compounds similar to DL-Alanyl-DL-alanyl-DL-alanine, N,N',N''-trimethyl-N''-(2-ethylhexyloxycarbonyl)-, 2-ethylhexyl ester.

Sources

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