- InChI
- InChI=1S/C26H43NO3/c1-3-4-5-6-7-8-9-10-11-12-13-17-22-30-26(29)23-27(2)25(28)21-20-24-18-15-14-16-19-24/h14-16,18-19H,3-13,17,20-23H2,1-2H3
- InChI Key
- MSTSIIPKJANIEB-UHFFFAOYSA-N
- Formula
- C26H43NO3
- SMILES
-
CCCCCCCCCCCCCCOC(=O)CN(C)C(=O)
CCc1ccccc1 - Molecular Weight1
- 417.62
- 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 | 1.1454 | Relay (1.0) Calculated Property | |
| ΔfG° | 28.39 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -735.65 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 64.54 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 128.92 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.62 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.94 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.322 | Crippen Calculated Property | |
| McVol | 372.430 | ml/mol | McGowan Calculated Property |
| Pc | 931.78 | kPa | Joback Calculated Property |
| Tboil | 680.87 | K | Relay (1.0) Calculated Property |
| Tc | 892.03 | K | Relay (1.0) Calculated Property |
| Tfus | 311.57 | K | Relay (1.0) Calculated Property |
| Vc | 1.401 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1258.09; 1350.11] | J/mol×K | [963.56; 1179.92] | 
|
| Cp,gas | 1258.09 | J/mol×K | 963.56 | Joback Calculated Property |
| Cp,gas | 1276.55 | J/mol×K | 999.62 | Joback Calculated Property |
| Cp,gas | 1293.65 | J/mol×K | 1035.68 | Joback Calculated Property |
| Cp,gas | 1309.48 | J/mol×K | 1071.74 | Joback Calculated Property |
| Cp,gas | 1324.11 | J/mol×K | 1107.80 | Joback Calculated Property |
| Cp,gas | 1337.63 | J/mol×K | 1143.86 | Joback Calculated Property |
| Cp,gas | 1350.11 | J/mol×K | 1179.92 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sarcosine, N-(3-phenylpropionyl)-, tetradecyl ester.
Sources
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