- InChI
- InChI=1S/C28H38O6/c1-21(2)31-23-13-17-25(18-14-23)33-27(29)11-9-7-5-6-8-10-12-28(30)34-26-19-15-24(16-20-26)32-22(3)4/h13-22H,5-12H2,1-4H3
- InChI Key
- IPDJFIZPGSWTCB-UHFFFAOYSA-N
- Formula
- C28H38O6
- SMILES
-
CC(C)Oc1ccc(OC(=O)CCCCCCCCC(=O
)Oc2ccc(OC(C)C)cc2)cc1 - Molecular Weight1
- 470.60
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 1.2409 | Relay (1.0) Calculated Property | |
| ΔfG° | -292.28 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1066.66 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 56.48 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 129.54 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.03 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.60 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.893 | Crippen Calculated Property | |
| McVol | 384.480 | ml/mol | McGowan Calculated Property |
| Pc | 976.56 | kPa | Joback Calculated Property |
| Inp | 3457.00 | NIST | |
| Tboil | 721.17 | K | Relay (1.0) Calculated Property |
| Tc | 951.90 | K | Relay (1.0) Calculated Property |
| Tfus | 392.22 | K | Relay (1.0) Calculated Property |
| Vc | 1.444 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1310.87; 1345.83] | J/mol×K | [1099.90; 1347.53] | 
|
| Cp,gas | 1310.87 | J/mol×K | 1099.90 | Joback Calculated Property |
| Cp,gas | 1322.22 | J/mol×K | 1141.17 | Joback Calculated Property |
| Cp,gas | 1331.31 | J/mol×K | 1182.44 | Joback Calculated Property |
| Cp,gas | 1338.18 | J/mol×K | 1223.71 | Joback Calculated Property |
| Cp,gas | 1342.86 | J/mol×K | 1264.99 | Joback Calculated Property |
| Cp,gas | 1345.40 | J/mol×K | 1306.26 | Joback Calculated Property |
| Cp,gas | 1345.83 | J/mol×K | 1347.53 | Joback Calculated Property |
| η | [0.0000079; 0.0001037] | Pa×s | [641.98; 1099.90] |
|
| η | 0.0001037 | Pa×s | 641.98 | Joback Calculated Property |
| η | 0.0000538 | Pa×s | 718.30 | Joback Calculated Property |
| η | 0.0000316 | Pa×s | 794.62 | Joback Calculated Property |
| η | 0.0000204 | Pa×s | 870.94 | Joback Calculated Property |
| η | 0.0000142 | Pa×s | 947.26 | Joback Calculated Property |
| η | 0.0000104 | Pa×s | 1023.58 | Joback Calculated Property |
| η | 0.0000079 | Pa×s | 1099.90 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sebacic acid, di(4-isopropoxyphenyl) ester.
Sources
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