- InChI
- InChI=1S/C28H44O6/c1-3-5-7-9-10-12-17-21-27(30)34-25(22-32-26(29)20-16-11-8-6-4-2)23-33-28(31)24-18-14-13-15-19-24/h13-15,18-19,25H,3-12,16-17,20-23H2,1-2H3
- InChI Key
- UHMVKVMCXUDQLN-UHFFFAOYSA-N
- Formula
- C28H44O6
- SMILES
-
CCCCCCCCCC(=O)OC(COC(=O)CCCCCC
C)COC(=O)c1ccccc1 - Molecular Weight1
- 476.65
- 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° | -406.91 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1124.40 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 67.16 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 107.28 | kJ/mol | Joback Calculated Property |
| log10WS | -7.92 | Crippen Calculated Property | |
| logPoct/wat | 6.800 | Crippen Calculated Property | |
| McVol | 403.940 | ml/mol | McGowan Calculated Property |
| Pc | 850.48 | kPa | Joback Calculated Property |
| Inp | [3207.50; 3207.50] |
|
|
| Inp | 3207.50 | NIST | |
| Inp | 3207.50 | NIST | |
| Tboil | 1095.15 | K | Joback Calculated Property |
| Tc | 1352.51 | K | Joback Calculated Property |
| Tfus | 633.22 | K | Joback Calculated Property |
| Vc | 1.562 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1409.47; 1465.21] | J/mol×K | [1095.15; 1352.51] |
|
| Cp,gas | 1409.47 | J/mol×K | 1095.15 | Joback Calculated Property |
| Cp,gas | 1424.16 | J/mol×K | 1138.04 | Joback Calculated Property |
| Cp,gas | 1436.60 | J/mol×K | 1180.94 | Joback Calculated Property |
| Cp,gas | 1446.84 | J/mol×K | 1223.83 | Joback Calculated Property |
| Cp,gas | 1454.98 | J/mol×K | 1266.72 | Joback Calculated Property |
| Cp,gas | 1461.08 | J/mol×K | 1309.62 | Joback Calculated Property |
| Cp,gas | 1465.21 | J/mol×K | 1352.51 | Joback Calculated Property |
| η | [0.0000100; 0.0001561] | Pa×s | [633.22; 1095.15] |
|
| η | 0.0001561 | Pa×s | 633.22 | Joback Calculated Property |
| η | 0.0000771 | Pa×s | 710.21 | Joback Calculated Property |
| η | 0.0000437 | Pa×s | 787.20 | Joback Calculated Property |
| η | 0.0000274 | Pa×s | 864.19 | Joback Calculated Property |
| η | 0.0000185 | Pa×s | 941.17 | Joback Calculated Property |
| η | 0.0000133 | Pa×s | 1018.16 | Joback Calculated Property |
| η | 0.0000100 | Pa×s | 1095.15 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-(Decanoyloxy)-3-(octanoyloxy)propyl benzoate.
Sources
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