- InChI
- InChI=1S/C22H43NO4/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-27-21(24)20-23(3)22(25)26-5-2/h4-20H2,1-3H3
- InChI Key
- XHUXETLDLGUTPW-UHFFFAOYSA-N
- Formula
- C22H43NO4
- SMILES
-
CCCCCCCCCCCCCCCCOC(=O)CN(C)C(=
O)OCC - Molecular Weight1
- 385.58
- 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 | 1.1327 | Relay (1.0) Calculated Property | |
| ΔfG° | -222.70 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1071.85 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 61.33 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 120.30 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.07 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.82 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.099 | Crippen Calculated Property | |
| McVol | 345.700 | ml/mol | McGowan Calculated Property |
| Pc | 952.60 | kPa | Joback Calculated Property |
| Inp | 2463.00 | NIST | |
| Tboil | 633.29 | K | Relay (1.0) Calculated Property |
| Tc | 818.14 | K | Relay (1.0) Calculated Property |
| Tfus | 298.38 | K | Relay (1.0) Calculated Property |
| Vc | 1.345 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1136.15; 1234.29] | J/mol×K | [867.78; 1062.48] | 
|
| Cp,gas | 1136.15 | J/mol×K | 867.78 | Joback Calculated Property |
| Cp,gas | 1155.53 | J/mol×K | 900.23 | Joback Calculated Property |
| Cp,gas | 1173.65 | J/mol×K | 932.68 | Joback Calculated Property |
| Cp,gas | 1190.55 | J/mol×K | 965.13 | Joback Calculated Property |
| Cp,gas | 1206.27 | J/mol×K | 997.58 | Joback Calculated Property |
| Cp,gas | 1220.84 | J/mol×K | 1030.03 | Joback Calculated Property |
| Cp,gas | 1234.29 | J/mol×K | 1062.48 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glycine, N-methyl-N-ethoxycarbonyl-, hexadecyl ester.
Sources
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