Chemical Properties of DL-Alanine, N-methyl-N-(3-chloro-2-methylpropoxycarbonyl)-, propyl ester

DL-Alanine, N-methyl-N-(3-chloro-2-methylpropoxycarbonyl)-, propyl ester

InChI
InChI=1S/C12H22ClNO4/c1-5-6-17-11(15)10(3)14(4)12(16)18-8-9(2)7-13/h9-10H,5-8H2,1-4H3
InChI Key
CYXKJWYMIOQBIG-UHFFFAOYSA-N
Formula
C12H22ClNO4
SMILES
CCCOC(=O)C(C)N(C)C(=O)OCC(C)CCl
Molecular Weight1
279.76
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Physical Properties

Property Value Unit Source
ΔfusH° 35.75 kJ/mol Joback Calculated Property
ΔvapH° 79.59 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 2.271 Crippen Calculated Property
McVol 217.040 ml/mol McGowan Calculated Property
Pc 1760.97 kPa Joback Calculated Property
Inp [1660.00; 1660.00]   Show Hide
Inp 1660.00 NIST
Inp 1660.00 NIST
Tboil 561.93 K Relay (1.0) Calculated Property
Tc 753.81 K Relay (1.0) Calculated Property
Tfus 259.31 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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 [573.79; 652.08] J/mol×K [639.59; 820.90] Show Hide
Cp,gas 573.79 J/mol×K 639.59 Joback Calculated Property
Cp,gas 588.87 J/mol×K 669.81 Joback Calculated Property
Cp,gas 603.12 J/mol×K 700.03 Joback Calculated Property
Cp,gas 616.56 J/mol×K 730.25 Joback Calculated Property
Cp,gas 629.20 J/mol×K 760.46 Joback Calculated Property
Cp,gas 641.03 J/mol×K 790.68 Joback Calculated Property
Cp,gas 652.08 J/mol×K 820.90 Joback Calculated Property

Similar Compounds

DL-Alanine, N-methyl-N-(3-chloro-2-methylpropoxycarbonyl)-, butyl ester. DL-Alanine, N-methyl-N-(3-chloropropoxycarbonyl)-, propyl ester. DL-Alanine, N-methyl-N-(3-chloropropoxycarbonyl)-, 3-chloropropyl ester. DL-Alanine, N-methyl-N-(3-chloro-2-methylpropoxycarbonyl)-, hexyl ester. DL-Alanine, N-methyl-N-(3-chloro-2-methylpropoxycarbonyl)-, undecyl ester. DL-Alanine, N-methyl-N-(3-chloro-2-methylpropoxycarbonyl)-, decyl ester. DL-Alanine, N-methyl-N-(3-chloro-2-methylpropoxycarbonyl)-, octyl ester. DL-Alanine, N-methyl-N-(3-chloro-2-methylpropoxycarbonyl)-, nonyl ester. DL-Alanine, N-methyl-N-(3-chloro-2-methylpropoxycarbonyl)-, heptyl ester. DL-Alanine, N-methyl-N-(3-chloro-2-methylpropoxycarbonyl)-, tridecyl ester. DL-Alanine, N-methyl-N-(3-chloro-2-methylpropoxycarbonyl)-, dodecyl ester. DL-Alanine, N-methyl-N-(byt-3-yn-1-yloxycarbonyl)-, isobutyl ester. DL-Alanine, N-methyl-N-(3-chloropropoxycarbonyl)-, pentyl ester. DL-Alanine, N-methyl-N-(3-chloropropoxycarbonyl)-, hexyl ester. DL-Alanine, N-methyl-N-(3-chloropropoxycarbonyl)-, tridecyl ester.

Find more compounds similar to DL-Alanine, N-methyl-N-(3-chloro-2-methylpropoxycarbonyl)-, propyl ester.

Sources

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