- InChI
- InChI=1S/C25H38O6/c1-2-3-4-9-12-17-28-24(26)13-10-7-5-6-8-11-14-25(27)29-19-21-15-16-22-23(18-21)31-20-30-22/h15-16,18H,2-14,17,19-20H2,1H3
- InChI Key
- AOPKLNYIRDCWIW-UHFFFAOYSA-N
- Formula
- C25H38O6
- SMILES
-
CCCCCCCOC(=O)CCCCCCCCC(=O)OCc1
ccc2c(c1)OCO2 - Molecular Weight1
- 434.57
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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° | -318.85 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1006.20 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 72.36 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 102.40 | kJ/mol | Joback Calculated Property |
| log10WS | -7.40 | Crippen Calculated Property | |
| logPoct/wat | 6.093 | Crippen Calculated Property | |
| McVol | 355.110 | ml/mol | McGowan Calculated Property |
| Pc | 1054.14 | kPa | Joback Calculated Property |
| Inp | [3151.00; 3151.00] |
|
|
| Inp | 3151.00 | NIST | |
| Inp | 3151.00 | NIST | |
| Tboil | 1025.93 | K | Joback Calculated Property |
| Tc | 1256.76 | K | Joback Calculated Property |
| Tfus | 642.61 | K | Joback Calculated Property |
| Vc | 1.375 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1223.25; 1301.63] | J/mol×K | [1025.93; 1256.76] |
|
| Cp,gas | 1223.25 | J/mol×K | 1025.93 | Joback Calculated Property |
| Cp,gas | 1239.30 | J/mol×K | 1064.40 | Joback Calculated Property |
| Cp,gas | 1254.05 | J/mol×K | 1102.87 | Joback Calculated Property |
| Cp,gas | 1267.57 | J/mol×K | 1141.34 | Joback Calculated Property |
| Cp,gas | 1279.95 | J/mol×K | 1179.81 | Joback Calculated Property |
| Cp,gas | 1291.28 | J/mol×K | 1218.29 | Joback Calculated Property |
| Cp,gas | 1301.63 | J/mol×K | 1256.76 | Joback Calculated Property |
| η | [0.0000478; 0.0003693] | Pa×s | [642.61; 1025.93] |
|
| η | 0.0003693 | Pa×s | 642.61 | Joback Calculated Property |
| η | 0.0002251 | Pa×s | 706.50 | Joback Calculated Property |
| η | 0.0001490 | Pa×s | 770.38 | Joback Calculated Property |
| η | 0.0001050 | Pa×s | 834.27 | Joback Calculated Property |
| η | 0.0000778 | Pa×s | 898.16 | Joback Calculated Property |
| η | 0.0000600 | Pa×s | 962.04 | Joback Calculated Property |
| η | 0.0000478 | Pa×s | 1025.93 | Joback Calculated Property |
Similar Compounds
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Sources
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