- InChI
- InChI=1S/C27H44O6/c1-4-5-6-7-10-13-16-22-32-25(28)20-14-11-8-9-12-15-21-26(29)33-27-23(30-2)18-17-19-24(27)31-3/h17-19H,4-16,20-22H2,1-3H3
- InChI Key
- IBVLYWGLRVLUIH-UHFFFAOYSA-N
- Formula
- C27H44O6
- SMILES
-
CCCCCCCCCOC(=O)CCCCCCCCC(=O)Oc
1c(OC)cccc1OC - Molecular Weight1
- 464.63
- 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° | -408.23 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1141.06 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 66.90 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 102.43 | kJ/mol | Joback Calculated Property |
| log10WS | -8.00 | Crippen Calculated Property | |
| logPoct/wat | 7.024 | Crippen Calculated Property | |
| McVol | 394.150 | ml/mol | McGowan Calculated Property |
| Pc | 839.67 | kPa | Joback Calculated Property |
| Inp | [3456.00; 3456.00] |
|
|
| Inp | 3456.00 | NIST | |
| Inp | 3456.00 | NIST | |
| Tboil | 1051.22 | K | Joback Calculated Property |
| Tc | 1295.42 | K | Joback Calculated Property |
| Tfus | 634.29 | K | Joback Calculated Property |
| Vc | 1.524 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1362.75; 1422.21] | J/mol×K | [1051.22; 1295.42] |
|
| Cp,gas | 1362.75 | J/mol×K | 1051.22 | Joback Calculated Property |
| Cp,gas | 1378.41 | J/mol×K | 1091.92 | Joback Calculated Property |
| Cp,gas | 1391.74 | J/mol×K | 1132.62 | Joback Calculated Property |
| Cp,gas | 1402.77 | J/mol×K | 1173.32 | Joback Calculated Property |
| Cp,gas | 1411.51 | J/mol×K | 1214.02 | Joback Calculated Property |
| Cp,gas | 1417.98 | J/mol×K | 1254.72 | Joback Calculated Property |
| Cp,gas | 1422.21 | J/mol×K | 1295.42 | Joback Calculated Property |
| η | [0.0000108; 0.0001138] | Pa×s | [634.29; 1051.22] |
|
| η | 0.0001138 | Pa×s | 634.29 | Joback Calculated Property |
| η | 0.0000633 | Pa×s | 703.78 | Joback Calculated Property |
| η | 0.0000392 | Pa×s | 773.27 | Joback Calculated Property |
| η | 0.0000262 | Pa×s | 842.75 | Joback Calculated Property |
| η | 0.0000187 | Pa×s | 912.24 | Joback Calculated Property |
| η | 0.0000139 | Pa×s | 981.73 | Joback Calculated Property |
| η | 0.0000108 | Pa×s | 1051.22 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sebacic acid, 2,6-dimethoxyphenyl nonyl ester.
Sources
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