Chemical Properties of DL-Alanine, N-methyl-N-(byt-2-yn-1-yloxycarbonyl)-, tridecyl ester

DL-Alanine, N-methyl-N-(byt-2-yn-1-yloxycarbonyl)-, tridecyl ester

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InChI
InChI=1S/C22H39NO4/c1-5-7-9-10-11-12-13-14-15-16-17-19-26-21(24)20(3)23(4)22(25)27-18-8-6-2/h20H,5,7,9-19H2,1-4H3
InChI Key
TZBNODJZOIFGFD-UHFFFAOYSA-N
Formula
C22H39NO4
SMILES
CC#CCOC(=O)N(C)C(C)C(=O)OCCCCCCCCCCCCC
Molecular Weight1
381.55
Sources

Physical Properties

Property Value Unit Source
Δf -22.34 kJ/mol Joback Calculated Property
Δfgas -652.46 kJ/mol Joback Calculated Property
Δfus 60.93 kJ/mol Joback Calculated Property
Δvap 86.68 kJ/mol Joback Calculated Property
logPoct/wat 5.32 Crippen Calculated Property
Pc 1059.64 kPa Joback Calculated Property
Tboil 876.34 K Joback Calculated Property
Tc 1074.36 K Joback Calculated Property
Tfus 605.59 K Joback Calculated Property
Vc 1.29 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1085.00 J/mol×K 876.34 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
-CH3 4
>N- 1
#C- 2
-CH2- 13
>C=O (nonring) 2

Similar Compounds

DL-Alanine, N-methyl-N-(byt-2-yn-1-yloxycarbonyl)-, heptadecyl ester. DL-Alanine, N-methyl-N-(byt-2-yn-1-yloxycarbonyl)-, tetradecyl ester. DL-Alanine, N-methyl-N-(byt-2-yn-1-yloxycarbonyl)-, undecyl ester. DL-Alanine, N-methyl-N-(byt-2-yn-1-yloxycarbonyl)-, nonyl ester. DL-Alanine, N-methyl-N-(byt-2-yn-1-yloxycarbonyl)-, dodecyl ester. DL-Alanine, N-methyl-N-(byt-2-yn-1-yloxycarbonyl)-, decyl ester. DL-Alanine, N-methyl-N-(byt-2-yn-1-yloxycarbonyl)-, hexadecyl ester. DL-Alanine, N-methyl-N-(byt-2-yn-1-yloxycarbonyl)-, octadecyl ester. DL-Alanine, N-methyl-N-(byt-2-yn-1-yloxycarbonyl)-, hexyl ester. DL-Alanine, N-methyl-N-decyloxycarbonyl-, pentadecyl ester. DL-Alanine, N-methyl-N-hexyloxycarbonyl-, octyl ester. DL-Alanine, N-methyl-N-hexyloxycarbonyl-, tridecyl ester. DL-Alanine, N-methyl-N-decyloxycarbonyl-, butyl ester. DL-Alanine, N-methyl-N-decyloxycarbonyl-, pentyl ester. DL-Alanine, N-methyl-N-hexyloxycarbonyl-, hexadecyl ester.

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