- InChI
- InChI=1S/C17H32N2O6/c1-6-23-16(21)18-11-9-8-10-14(19-17(22)24-7-2)15(20)25-13(5)12(3)4/h12-14H,6-11H2,1-5H3,(H,18,21)(H,19,22)/t13-,14?/m1/s1
- InChI Key
- GKTOTRKMGWTYSG-KWCCSABGSA-N
- Formula
- C17H32N2O6
- SMILES
-
CCOC(=O)NCCCCC(NC(=O)OCC)C(=O)
OC(C)C(C)C - Molecular Weight1
- 360.45
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.9807 | Relay (1.0) Calculated Property | |
| ΔfG° | -438.04 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1354.41 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 47.78 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 105.88 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.89 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.99 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.605 | Crippen Calculated Property | |
| McVol | 292.670 | ml/mol | McGowan Calculated Property |
| Pc | 1411.18 | kPa | Joback Calculated Property |
| Inp | 2383.30 | NIST | |
| Tboil | 610.96 | K | Relay (1.0) Calculated Property |
| Tc | 816.67 | K | Relay (1.0) Calculated Property |
| Tfus | 325.02 | K | Relay (1.0) Calculated Property |
| Vc | 1.066 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [962.30; 1027.04] | J/mol×K | [916.25; 1122.68] | 
|
| Cp,gas | 962.30 | J/mol×K | 916.25 | Joback Calculated Property |
| Cp,gas | 976.41 | J/mol×K | 950.65 | Joback Calculated Property |
| Cp,gas | 989.19 | J/mol×K | 985.06 | Joback Calculated Property |
| Cp,gas | 1000.64 | J/mol×K | 1019.46 | Joback Calculated Property |
| Cp,gas | 1010.76 | J/mol×K | 1053.87 | Joback Calculated Property |
| Cp,gas | 1019.56 | J/mol×K | 1088.27 | Joback Calculated Property |
| Cp,gas | 1027.04 | J/mol×K | 1122.68 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to L-Lysine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester.
Sources
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