Chemical Properties of 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''-octyloxycarbonyl-, octyl ester

InChI
InChI=1S/C29H55N3O6/c1-9-11-13-15-17-19-21-37-28(35)25(5)31(7)26(33)23(3)30(6)27(34)24(4)32(8)29(36)38-22-20-18-16-14-12-10-2/h23-25H,9-22H2,1-8H3
InChI Key
PQQDOLGKLAJPMB-UHFFFAOYSA-N
Formula
C29H55N3O6
SMILES
CCCCCCCCOC(=O)C(C)N(C)C(=O)C(C)N(C)C(=O)C(C)N(C)C(=O)OCCCCCCCC
Molecular Weight1
541.76
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Physical Properties

Property Value Unit Source
ω 1.3125 Relay (1.0) Calculated Property
ΔfG° -207.36 kJ/mol Joback Calculated Property
ΔfH°gas -1431.55 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 78.13 kJ/mol Joback Calculated Property
ΔvapH° 130.47 kJ/mol Relay (1.0) Calculated Property
IE 8.21 eV Relay (1.0) Calculated Property
log10WS -4.99 Relay (1.0) Calculated Property
logPoct/wat 5.401 Crippen Calculated Property
McVol 467.430 ml/mol McGowan Calculated Property
Pc 705.08 kPa Joback Calculated Property
Inp [3406.00; 3406.00]   Show Hide
Inp 3406.00 NIST
Inp 3406.00 NIST
Tboil 670.53 K Relay (1.0) Calculated Property
Tc 904.80 K Relay (1.0) Calculated Property
Tfus 339.26 K Relay (1.0) Calculated Property
Vc 1.737 m3/kmol Relay (1.0) Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1702.68; 1780.85] J/mol×K [1159.24; 1478.13] Show Hide
Cp,gas 1702.68 J/mol×K 1159.24 Joback Calculated Property
Cp,gas 1722.12 J/mol×K 1212.39 Joback Calculated Property
Cp,gas 1738.63 J/mol×K 1265.54 Joback Calculated Property
Cp,gas 1752.50 J/mol×K 1318.68 Joback Calculated Property
Cp,gas 1763.97 J/mol×K 1371.83 Joback Calculated Property
Cp,gas 1773.33 J/mol×K 1424.98 Joback Calculated Property
Cp,gas 1780.85 J/mol×K 1478.13 Joback Calculated Property

Similar Compounds

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'-(3-chloropropoxycarbonyl)-, octyl 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'-(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)-, tetradecyl ester. DL-Alanyl-DL-alanine, N,N'-dimethyl-N'-(byt-4-en-1-yloxycarbonyl)-, hexyl 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-octyloxycarbonyl-, octyl ester.

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

Sources

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