Chemical Properties of DL-Alanyl-DL-alanine, N,N'-dimethyl-N'-(3-chloropropoxycarbonyl)-, nonyl ester

DL-Alanyl-DL-alanine, N,N'-dimethyl-N'-(3-chloropropoxycarbonyl)-, nonyl ester

InChI
InChI=1S/C21H39ClN2O5/c1-6-7-8-9-10-11-12-15-28-20(26)18(3)23(4)19(25)17(2)24(5)21(27)29-16-13-14-22/h17-18H,6-16H2,1-5H3
InChI Key
RITFJYUFJFEZJH-UHFFFAOYSA-N
Formula
C21H39ClN2O5
SMILES
CCCCCCCCCOC(=O)C(C)N(C)C(=O)C(C)N(C)C(=O)OCCCCl
Molecular Weight1
435.00
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Physical Properties

Property Value Unit Source
ΔfH°gas -1197.00 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 63.68 kJ/mol Joback Calculated Property
ΔvapH° 112.94 kJ/mol Relay (1.0) Calculated Property
log10WS -4.03 Relay (1.0) Calculated Property
logPoct/wat 4.213 Crippen Calculated Property
McVol 355.400 ml/mol McGowan Calculated Property
Inp [2195.00; 2195.00]   Show Hide
Inp 2195.00 NIST
Inp 2195.00 NIST
Tboil 630.83 K Relay (1.0) Calculated Property
Tfus 308.85 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, 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 [1153.81; 1232.22] J/mol×K [911.82; 1116.39] Show Hide
Cp,gas 1153.81 J/mol×K 911.82 Joback Calculated Property
Cp,gas 1170.21 J/mol×K 945.92 Joback Calculated Property
Cp,gas 1185.22 J/mol×K 980.01 Joback Calculated Property
Cp,gas 1198.87 J/mol×K 1014.11 Joback Calculated Property
Cp,gas 1211.22 J/mol×K 1048.20 Joback Calculated Property
Cp,gas 1222.32 J/mol×K 1082.30 Joback Calculated Property
Cp,gas 1232.22 J/mol×K 1116.39 Joback Calculated Property

Similar Compounds

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'-octyloxycarbonyl-, octyl ester. DL-Alanyl-DL-alanine, N,N'-dimethyl-N'-hexyloxycarbonyl-, hexyl 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'-(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'-dimethyl-N'-(byt-4-en-1-yloxycarbonyl)-, 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'-(byt-4-en-1-yloxycarbonyl)-, pentyl ester. DL-Alanyl-DL-alanine, N,N'-dimethyl-N'-(2-ethylhexyloxycarbonyl)-, 2-ethylhexyl 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'-(byt-4-en-1-yloxycarbonyl)-, byt-4-en-1-yl ester. DL-Valyl-DL-Valine, N,N'-dimethyl-N'-(3-chloropropoxycarbonyl)-, octyl ester.

Find more compounds similar to DL-Alanyl-DL-alanine, N,N'-dimethyl-N'-(3-chloropropoxycarbonyl)-, nonyl ester.

Sources

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