Chemical Properties of 2-Aminopent-4-enoic acid, N-octyloxycarbonyl-, octyl ester

2-Aminopent-4-enoic acid, N-octyloxycarbonyl-, octyl ester

InChI
InChI=1S/C22H41NO4/c1-4-7-9-11-13-15-18-26-21(24)20(17-6-3)23-22(25)27-19-16-14-12-10-8-5-2/h6,20H,3-5,7-19H2,1-2H3,(H,23,25)
InChI Key
CMCGVYXSNLJGTO-UHFFFAOYSA-N
Formula
C22H41NO4
SMILES
C=CCC(N=C(O)OCCCCCCCC)C(=O)OCCCCCCCC
Molecular Weight1
383.57
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
Δvap 120.82 kJ/mol Relay (1.0) Calculated Property
log10WS -5.54 Relay (1.0) Calculated Property
logPoct/wat 6.126 Crippen Calculated Property
McVol 341.400 ml/mol McGowan Calculated Property
Inp [2515.00; 2515.00]   Show Hide
Inp 2515.00 NIST
Inp 2515.00 NIST
Tboil 649.75 K Relay (1.0) Calculated Property
Tfus 304.98 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, 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.

Similar Compounds

2-Aminopent-4-enoic acid, N-octyloxycarbonyl-, tridecyl ester. 2-Aminopent-4-enoic acid, N-decyloxycarbonyl-, dodecyl ester. 2-Aminopent-4-enoic acid, N-decyloxycarbonyl-, tetradecyl ester. 2-Aminopent-4-enoic acid, N-octyloxycarbonyl-, decyl ester. 2-Aminopent-4-enoic acid, N-octyloxycarbonyl-, dodecyl ester. 2-Aminopent-4-enoic acid, N-hexyloxycarbonyl-, undecyl ester. 2-Aminopent-4-enoic acid, N-octyloxycarbonyl-, nonyl ester. 2-Aminopent-4-enoic acid, N-hexyloxycarbonyl-, tridecyl ester. 2-Aminopent-4-enoic acid, N-octyloxycarbonyl-, heptyl ester. 2-Aminopent-4-enoic acid, N-octyloxycarbonyl-, undecyl ester. 2-Aminopent-4-enoic acid, N-decyloxycarbonyl-, heptyl ester. 2-Aminopent-4-enoic acid, N-hexyloxycarbonyl-, decyl ester. 2-Aminopent-4-enoic acid, N-decyloxycarbonyl-, nonyl ester. 2-Aminopent-4-enoic acid, N-octyloxycarbonyl-, pentyl ester. 2-Aminopent-4-enoic acid, N-octyloxycarbonyl-, butyl ester.

Find more compounds similar to 2-Aminopent-4-enoic acid, N-octyloxycarbonyl-, octyl ester.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.