Chemical Properties of DL-Alanine, N-methyl-N-(3-chloropropoxycarbonyl)-, 3-chloropropyl ester

DL-Alanine, N-methyl-N-(3-chloropropoxycarbonyl)-, 3-chloropropyl ester

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InChI
InChI=1S/C11H19Cl2NO4/c1-9(10(15)17-7-3-5-12)14(2)11(16)18-8-4-6-13/h9H,3-8H2,1-2H3
InChI Key
SJXUQVYCJBCXSB-UHFFFAOYSA-N
Formula
C11H19Cl2NO4
SMILES
CC(C(=O)OCCCCl)N(C)C(=O)OCCCCl
Molecular Weight1
300.18
Sources

Physical Properties

Property Value Unit Source
Δf -341.62 kJ/mol Joback Calculated Property
Δfgas -729.20 kJ/mol Joback Calculated Property
Δfus 37.71 kJ/mol Joback Calculated Property
Δvap 68.82 kJ/mol Joback Calculated Property
logPoct/wat 2.24 Crippen Calculated Property
Pc 1975.31 kPa Joback Calculated Property
Tboil 690.52 K Joback Calculated Property
Tc 879.11 K Joback Calculated Property
Tfus 435.36 K Joback Calculated Property
Vc 0.81 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 559.82 J/mol×K 690.52 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
-Cl 2
>C=O (nonring) 2
>N- 1
-CH2- 6
-CH3 2

Similar Compounds

DL-Alanine, N-methyl-N-(3-chloropropoxycarbonyl)-, propyl ester. DL-Alanine, N-methyl-N-(3-chloro-2-methylpropoxycarbonyl)-, propyl ester. DL-Alanine, N-methyl-N-(3-chloropropoxycarbonyl)-, octadecyl ester. DL-Alanine, N-methyl-N-(byt-2-yn-1-yloxycarbonyl)-, propyl ester. DL-Alanine, N-methyl-N-hexyloxycarbonyl-, heptyl ester. DL-Alanine, N-methyl-N-hexyloxycarbonyl-, decyl ester. DL-Alanine, N-methyl-N-decyloxycarbonyl-, nonyl ester. DL-Alanine, N-methyl-N-decyloxycarbonyl-, tridecyl ester. DL-Alanine, N-methyl-N-octyloxycarbonyl-, octyl ester. DL-Alanine, N-methyl-N-hexyloxycarbonyl-, hexadecyl ester. DL-Alanine, N-methyl-N-decyloxycarbonyl-, pentadecyl ester. DL-Alanine, N-methyl-N-octyloxycarbonyl-, tetradecyl ester. DL-Alanine, N-methyl-N-hexyloxycarbonyl-, octyl ester. DL-Alanine, N-methyl-N-hexyloxycarbonyl-, tridecyl ester. DL-Alanine, N-methyl-N-octyloxycarbonyl-, dodecyl ester.

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