- InChI
- InChI=1S/C26H37NO5/c1-31-26(30)23(27-24(28)16-12-19-6-2-3-7-19)18-21-10-14-22(15-11-21)32-25(29)17-13-20-8-4-5-9-20/h10-11,14-15,19-20,23H,2-9,12-13,16-18H2,1H3,(H,27,28)
- InChI Key
- JXGANONFBSEACI-UHFFFAOYSA-N
- Formula
- C26H37NO5
- SMILES
-
COC(=O)C(Cc1ccc(OC(=O)CCC2CCCC
2)cc1)NC(=O)CCC1CCCC1 - Molecular Weight1
- 443.58
- 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).
- 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° | -165.89 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -787.94 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 53.37 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 108.03 | kJ/mol | Joback Calculated Property |
| log10WS | -6.53 | Crippen Calculated Property | |
| logPoct/wat | 4.733 | Crippen Calculated Property | |
| McVol | 358.150 | ml/mol | McGowan Calculated Property |
| Pc | 1220.85 | kPa | Joback Calculated Property |
| Tboil | 1112.68 | K | Joback Calculated Property |
| Tc | 1362.59 | K | Joback Calculated Property |
| Tfus | 675.43 | K | Joback Calculated Property |
| Vc | 1.349 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1291.09; 1342.13] | J/mol×K | [1112.68; 1362.59] | 
|
| Cp,gas | 1291.09 | J/mol×K | 1112.68 | Joback Calculated Property |
| Cp,gas | 1303.69 | J/mol×K | 1154.33 | Joback Calculated Property |
| Cp,gas | 1314.51 | J/mol×K | 1195.98 | Joback Calculated Property |
| Cp,gas | 1323.65 | J/mol×K | 1237.63 | Joback Calculated Property |
| Cp,gas | 1331.23 | J/mol×K | 1279.29 | Joback Calculated Property |
| Cp,gas | 1337.36 | J/mol×K | 1320.94 | Joback Calculated Property |
| Cp,gas | 1342.13 | J/mol×K | 1362.59 | Joback Calculated Property |
Similar Compounds
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Sources
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