Chemical Properties of DL-3-Aminobutanoic acid, N-(2-ethylhexyl)oxycarbonyl-, undecyl ester

DL-3-Aminobutanoic acid, N-(2-ethylhexyl)oxycarbonyl-, undecyl ester

InChI
InChI=1S/C24H47NO4/c1-5-8-10-11-12-13-14-15-16-18-28-23(26)19-21(4)25-24(27)29-20-22(7-3)17-9-6-2/h21-22H,5-20H2,1-4H3,(H,25,27)
InChI Key
AKGHEMYFECZURY-UHFFFAOYSA-N
Formula
C24H47NO4
SMILES
CCCCCCCCCCCOC(=O)CC(C)N=C(O)OCC(CC)CCCC
Molecular Weight1
413.63
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Physical Properties

Property Value Unit Source
Δfgas -1186.43 kJ/mol Relay (1.0) Calculated Property
Δvap 131.68 kJ/mol Relay (1.0) Calculated Property
log10WS -5.93 Relay (1.0) Calculated Property
logPoct/wat 6.986 Crippen Calculated Property
McVol 373.880 ml/mol McGowan Calculated Property
Pc 823.37 kPa Joback Calculated Property
Inp [2782.00; 2782.00]   Show Hide
Inp 2782.00 NIST
Inp 2782.00 NIST
Tboil 636.66 K Relay (1.0) Calculated Property
Tfus 290.87 K Relay (1.0) Calculated Property

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Similar Compounds

DL-3-Aminobutanoic acid, N-(2-ethylhexyl)oxycarbonyl-, tetradecyl ester. DL-3-Aminobutanoic acid, N-(2-ethylhexyl)oxycarbonyl-, dodecyl ester. DL-3-Aminobutanoic acid, N-(2-ethylhexyl)oxycarbonyl-, tridecyl ester. DL-3-Aminobutanoic acid, N-(2-ethylhexyl)oxycarbonyl-, nonyl ester. DL-3-Aminobutanoic acid, N-(2-ethylhexyl)oxycarbonyl-, pentadecyl ester. DL-3-Aminobutanoic acid, N-(2-ethylhexyl)oxycarbonyl-, decyl ester. DL-3-Aminobutanoic acid, N-(2-ethylhexyl)oxycarbonyl-, hexyl ester. DL-3-Aminobutanoic acid, N-(2-ethylhexyl)oxycarbonyl-, pentyl ester. DL-3-Aminobutanoic acid, N-(2-ethylhexyl)oxycarbonyl-, heptyl ester. DL-3-Aminobutanoic acid, N-(2-ethylhexyl)oxycarbonyl-, 2-ethylhexyl ester. DL-3-Aminobutanoic acid, N-hexyloxycarbonyl-, undecyl ester. DL-3-Aminobutanoic acid, N-hexyloxycarbonyl-, decyl ester. DL-3-Aminobutanoic acid, N-hexyloxycarbonyl-, dodecyl ester. DL-3-Aminobutanoic acid, N-hexyloxycarbonyl-, tetradecyl ester. DL-3-Aminobutanoic acid, N-hexyloxycarbonyl-, heptyl ester.

Find more compounds similar to DL-3-Aminobutanoic acid, N-(2-ethylhexyl)oxycarbonyl-, undecyl ester.

Sources

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