- InChI
- InChI=1S/C27H44O4/c1-3-5-6-7-12-18-23-30-26(28)21-16-10-8-9-11-17-22-27(29)31-25(4-2)24-19-14-13-15-20-24/h13-15,19-20,25H,3-12,16-18,21-23H2,1-2H3
- InChI Key
- WQJHPOMKNNGSAP-UHFFFAOYSA-N
- Formula
- C27H44O4
- SMILES
-
CCCCCCCCOC(=O)CCCCCCCCC(=O)OC(
CC)c1ccccc1 - Molecular Weight1
- 432.64
- 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° | -181.41 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -858.96 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 61.78 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 95.90 | kJ/mol | Joback Calculated Property |
| log10WS | -8.41 | Crippen Calculated Property | |
| logPoct/wat | 7.705 | Crippen Calculated Property | |
| McVol | 382.410 | ml/mol | McGowan Calculated Property |
| Pc | 875.84 | kPa | Joback Calculated Property |
| Inp | 3066.00 | NIST | |
| Tboil | 995.98 | K | Joback Calculated Property |
| Tc | 1220.65 | K | Joback Calculated Property |
| Tfus | 549.79 | K | Joback Calculated Property |
| Vc | 1.482 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1307.33; 1391.84] | J/mol×K | [995.98; 1220.65] | 
|
| Cp,gas | 1307.33 | J/mol×K | 995.98 | Joback Calculated Property |
| Cp,gas | 1325.24 | J/mol×K | 1033.43 | Joback Calculated Property |
| Cp,gas | 1341.54 | J/mol×K | 1070.87 | Joback Calculated Property |
| Cp,gas | 1356.28 | J/mol×K | 1108.32 | Joback Calculated Property |
| Cp,gas | 1369.53 | J/mol×K | 1145.76 | Joback Calculated Property |
| Cp,gas | 1381.36 | J/mol×K | 1183.21 | Joback Calculated Property |
| Cp,gas | 1391.84 | J/mol×K | 1220.65 | Joback Calculated Property |
| η | [0.0000174; 0.0003426] | Pa×s | [549.79; 995.98] |
|
| η | 0.0003426 | Pa×s | 549.79 | Joback Calculated Property |
| η | 0.0001550 | Pa×s | 624.15 | Joback Calculated Property |
| η | 0.0000830 | Pa×s | 698.52 | Joback Calculated Property |
| η | 0.0000501 | Pa×s | 772.88 | Joback Calculated Property |
| η | 0.0000331 | Pa×s | 847.25 | Joback Calculated Property |
| η | 0.0000233 | Pa×s | 921.62 | Joback Calculated Property |
| η | 0.0000174 | Pa×s | 995.98 | Joback Calculated Property |
Similar Compounds
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Sources
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