Chemical Properties of DL-Alanine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, octyl ester

DL-Alanine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, octyl ester

InChI
InChI=1S/C21H41NO4/c1-6-9-11-12-13-14-16-25-20(23)18(4)22(5)21(24)26-17-19(8-3)15-10-7-2/h18-19H,6-17H2,1-5H3
InChI Key
LJGJZZWCQLETGT-UHFFFAOYSA-N
Formula
C21H41NO4
SMILES
CCCCCCCCOC(=O)C(C)N(C)C(=O)OCC(CC)CCCC
Molecular Weight1
371.56
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Physical Properties

Property Value Unit Source
ΔfH°gas -1069.92 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 51.69 kJ/mol Joback Calculated Property
ΔvapH° 103.43 kJ/mol Relay (1.0) Calculated Property
log10WS -5.04 Relay (1.0) Calculated Property
logPoct/wat 5.563 Crippen Calculated Property
McVol 331.610 ml/mol McGowan Calculated Property
Pc 1022.04 kPa Joback Calculated Property
Inp [2308.00; 2308.00]   Show Hide
Inp 2308.00 NIST
Inp 2308.00 NIST
Tboil 615.60 K Relay (1.0) Calculated Property
Tfus 246.37 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, 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 [1074.95; 1171.23] J/mol×K [844.02; 1034.17] Show Hide
Cp,gas 1074.95 J/mol×K 844.02 Joback Calculated Property
Cp,gas 1093.87 J/mol×K 875.71 Joback Calculated Property
Cp,gas 1111.61 J/mol×K 907.40 Joback Calculated Property
Cp,gas 1128.18 J/mol×K 939.09 Joback Calculated Property
Cp,gas 1143.62 J/mol×K 970.78 Joback Calculated Property
Cp,gas 1157.96 J/mol×K 1002.48 Joback Calculated Property
Cp,gas 1171.23 J/mol×K 1034.17 Joback Calculated Property

Similar Compounds

DL-Alanine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, tridecyl ester. DL-Alanine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, decyl ester. DL-Alanine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, pentadecyl ester. DL-Alanine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, undecyl ester. DL-Alanine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, nonyl ester. DL-Alanine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, heptadecyl ester. DL-Alanine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, hexadecyl ester. DL-Alanine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, dodecyl ester. DL-Alanine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, tetradecyl ester. DL-Alanine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, octadecyl ester. DL-Alanine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, 2-ethylhexyl ester. DL-Alanine, N-methyl-N-decyloxycarbonyl-, isobutyl ester. DL-Alanine, N-methyl-N-hexyloxycarbonyl-, isobutyl ester. DL-Alanine, N-methyl-N-(3-chloro-2-methylpropoxycarbonyl)-, heptyl ester. DL-Alanine, N-methyl-N-(3-chloro-2-methylpropoxycarbonyl)-, octyl ester.

Find more compounds similar to DL-Alanine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, octyl ester.

Sources

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