- InChI
- InChI=1S/C26H49NO3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-30-26(29)23-27(4)25(28)22-24(2)3/h22H,5-21,23H2,1-4H3
- InChI Key
- GGXUXWAUGWEDIZ-UHFFFAOYSA-N
- Formula
- C26H49NO3
- SMILES
-
CCCCCCCCCCCCCCCCCCOC(=O)CN(C)C
(=O)C=C(C)C - Molecular Weight1
- 423.67
- 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).
- 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 | 1.1782 | Relay (1.0) Calculated Property | |
| ΔfG° | -12.35 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -893.67 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 69.40 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 125.90 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.68 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.02 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.216 | Crippen Calculated Property | |
| McVol | 391.890 | ml/mol | McGowan Calculated Property |
| Pc | 793.49 | kPa | Joback Calculated Property |
| Tboil | 651.86 | K | Relay (1.0) Calculated Property |
| Tc | 856.03 | K | Relay (1.0) Calculated Property |
| Tfus | 324.77 | K | Relay (1.0) Calculated Property |
| Vc | 1.494 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1329.94; 1439.17] | J/mol×K | [940.92; 1155.26] | 
|
| Cp,gas | 1329.94 | J/mol×K | 940.92 | Joback Calculated Property |
| Cp,gas | 1351.23 | J/mol×K | 976.64 | Joback Calculated Property |
| Cp,gas | 1371.16 | J/mol×K | 1012.37 | Joback Calculated Property |
| Cp,gas | 1389.84 | J/mol×K | 1048.09 | Joback Calculated Property |
| Cp,gas | 1407.35 | J/mol×K | 1083.82 | Joback Calculated Property |
| Cp,gas | 1423.76 | J/mol×K | 1119.54 | Joback Calculated Property |
| Cp,gas | 1439.17 | J/mol×K | 1155.26 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sarcosine, N-(3-methylbut-2-enoyl)-, octadecyl ester.
Sources
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