- InChI
- InChI=1S/C25H40O5/c1-3-4-5-6-11-14-21-29-24(26)15-12-9-7-8-10-13-16-25(27)30-23-19-17-22(28-2)18-20-23/h17-20H,3-16,21H2,1-2H3
- InChI Key
- GMFWVRSBDAAFGA-UHFFFAOYSA-N
- Formula
- C25H40O5
- SMILES
-
CCCCCCCCOC(=O)CCCCCCCCC(=O)Oc1
ccc(OC)cc1 - Molecular Weight1
- 420.58
- 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 | 1.2326 | Relay (1.0) Calculated Property | |
| ΔfG° | -310.44 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1053.15 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 60.92 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 122.03 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.13 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.55 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.625 | Crippen Calculated Property | |
| McVol | 360.100 | ml/mol | McGowan Calculated Property |
| Pc | 960.29 | kPa | Joback Calculated Property |
| Inp | 3251.00 | NIST | |
| Tboil | 684.43 | K | Relay (1.0) Calculated Property |
| Tc | 879.91 | K | Relay (1.0) Calculated Property |
| Tfus | 328.56 | K | Relay (1.0) Calculated Property |
| Vc | 1.363 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1210.94; 1286.41] | J/mol×K | [978.06; 1197.84] | 
|
| Cp,gas | 1210.94 | J/mol×K | 978.06 | Joback Calculated Property |
| Cp,gas | 1227.53 | J/mol×K | 1014.69 | Joback Calculated Property |
| Cp,gas | 1242.47 | J/mol×K | 1051.32 | Joback Calculated Property |
| Cp,gas | 1255.79 | J/mol×K | 1087.95 | Joback Calculated Property |
| Cp,gas | 1267.54 | J/mol×K | 1124.58 | Joback Calculated Property |
| Cp,gas | 1277.74 | J/mol×K | 1161.21 | Joback Calculated Property |
| Cp,gas | 1286.41 | J/mol×K | 1197.84 | Joback Calculated Property |
| η | [0.0000196; 0.0002363] | Pa×s | [577.00; 978.06] |
|
| η | 0.0002363 | Pa×s | 577.00 | Joback Calculated Property |
| η | 0.0001258 | Pa×s | 643.84 | Joback Calculated Property |
| η | 0.0000754 | Pa×s | 710.69 | Joback Calculated Property |
| η | 0.0000493 | Pa×s | 777.53 | Joback Calculated Property |
| η | 0.0000345 | Pa×s | 844.37 | Joback Calculated Property |
| η | 0.0000255 | Pa×s | 911.22 | Joback Calculated Property |
| η | 0.0000196 | Pa×s | 978.06 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sebacic acid, 4-methoxyphenyl octyl ester.
Sources
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