- InChI
- InChI=1S/C26H43NO4/c1-3-4-5-6-7-8-9-10-11-12-15-21-31-26(29)20-16-19-25(28)27-22-23-17-13-14-18-24(23)30-2/h13-14,17-18H,3-12,15-16,19-22H2,1-2H3,(H,27,28)
- InChI Key
- VWTASEJZXXBOPZ-UHFFFAOYSA-N
- Formula
- C26H43NO4
- SMILES
-
CCCCCCCCCCCCCOC(=O)CCCC(=O)NCc
1ccccc1OC - Molecular Weight1
- 433.62
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -107.63 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -791.04 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 67.42 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 101.16 | kJ/mol | Joback Calculated Property |
| log10WS | -7.83 | Crippen Calculated Property | |
| logPoct/wat | 6.336 | Crippen Calculated Property | |
| McVol | 378.300 | ml/mol | McGowan Calculated Property |
| Pc | 922.18 | kPa | Joback Calculated Property |
| Inp | 3448.00 | NIST | |
| Tboil | 1028.69 | K | Joback Calculated Property |
| Tc | 1263.06 | K | Joback Calculated Property |
| Tfus | 618.70 | K | Joback Calculated Property |
| Vc | 1.466 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1304.52; 1380.80] | J/mol×K | [1028.69; 1263.06] | 
|
| Cp,gas | 1304.52 | J/mol×K | 1028.69 | Joback Calculated Property |
| Cp,gas | 1321.30 | J/mol×K | 1067.75 | Joback Calculated Property |
| Cp,gas | 1336.37 | J/mol×K | 1106.81 | Joback Calculated Property |
| Cp,gas | 1349.79 | J/mol×K | 1145.87 | Joback Calculated Property |
| Cp,gas | 1361.63 | J/mol×K | 1184.94 | Joback Calculated Property |
| Cp,gas | 1371.94 | J/mol×K | 1224.00 | Joback Calculated Property |
| Cp,gas | 1380.80 | J/mol×K | 1263.06 | Joback Calculated Property |
Similar Compounds
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Sources
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