- InChI
- InChI=1S/C26H51NO3/c1-4-6-8-9-10-11-12-13-14-15-16-17-18-19-21-23-30-26(29)24-27(3)25(28)22-20-7-5-2/h4-24H2,1-3H3
- InChI Key
- WWKUJGWIUXURRB-UHFFFAOYSA-N
- Formula
- C26H51NO3
- SMILES
-
CCCCCCCCCCCCCCCCCOC(=O)CN(C)C(
=O)CCCCC - Molecular Weight1
- 425.69
- 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 | 1.2238 | Relay (... Calculated Property | |
| ΔfG° | -84.02 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -983.72 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 70.50 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 125.99 | kJ/mol | Relay (... Calculated Property |
| IE | 8.93 | eV | Relay (... Calculated Property |
| log10WS | -6.55 | Relay (... Calculated Property | |
| logPoct/wat | 7.440 | Crippen Calculated Property | |
| McVol | 396.190 | ml/mol | McGowan Calculated Property |
| Pc | 768.61 | kPa | Joback Calculated Property |
| Tboil | 652.59 | K | Relay (... Calculated Property |
| Tc | 846.14 | K | Relay (... Calculated Property |
| Tfus | 315.71 | K | Relay (... Calculated Property |
| Vc | 1.534 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1357.77; 1468.27] | J/mol×K | [936.88; 1153.23] | 
|
| Cp,gas | 1357.77 | J/mol×K | 936.88 | Joback Calculated Property |
| Cp,gas | 1379.76 | J/mol×K | 972.94 | Joback Calculated Property |
| Cp,gas | 1400.23 | J/mol×K | 1009.00 | Joback Calculated Property |
| Cp,gas | 1419.24 | J/mol×K | 1045.05 | Joback Calculated Property |
| Cp,gas | 1436.86 | J/mol×K | 1081.11 | Joback Calculated Property |
| Cp,gas | 1453.18 | J/mol×K | 1117.17 | Joback Calculated Property |
| Cp,gas | 1468.27 | J/mol×K | 1153.23 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sarcosine, n-hexanoyl-, heptadecyl ester.
Sources
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