- InChI
- InChI=1S/C31H50O4/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-23-27-35-31(33)29-25-21-20-24-28(29)30(32)34-26-22-6-4-2/h4,20-21,24-25H,2-3,5-19,22-23,26-27H2,1H3
- InChI Key
- MWFDHAYJSNSOJR-UHFFFAOYSA-N
- Formula
- C31H50O4
- SMILES
-
C=CCCCOC(=O)c1ccccc1C(=O)OCCCC
CCCCCCCCCCCCCC - Molecular Weight1
- 486.73
- 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° | -67.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -822.28 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 73.99 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 105.18 | kJ/mol | Joback Calculated Property |
| log10WS | -10.60 | Crippen Calculated Property | |
| logPoct/wat | 9.228 | Crippen Calculated Property | |
| McVol | 434.470 | ml/mol | McGowan Calculated Property |
| Pc | 713.39 | kPa | Joback Calculated Property |
| Inp | 3465.00 | NIST | |
| Tboil | 1089.60 | K | Joback Calculated Property |
| Tc | 1352.16 | K | Joback Calculated Property |
| Tfus | 620.63 | K | Joback Calculated Property |
| Vc | 1.692 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1529.81; 1615.58] | J/mol×K | [1089.60; 1352.16] | 
|
| Cp,gas | 1529.81 | J/mol×K | 1089.60 | Joback Calculated Property |
| Cp,gas | 1548.93 | J/mol×K | 1133.36 | Joback Calculated Property |
| Cp,gas | 1565.95 | J/mol×K | 1177.12 | Joback Calculated Property |
| Cp,gas | 1581.00 | J/mol×K | 1220.88 | Joback Calculated Property |
| Cp,gas | 1594.21 | J/mol×K | 1264.64 | Joback Calculated Property |
| Cp,gas | 1605.69 | J/mol×K | 1308.40 | Joback Calculated Property |
| Cp,gas | 1615.58 | J/mol×K | 1352.16 | Joback Calculated Property |
| η | [0.0000113; 0.0001676] | Pa×s | [620.63; 1089.60] |
|
| η | 0.0001676 | Pa×s | 620.63 | Joback Calculated Property |
| η | 0.0000833 | Pa×s | 698.79 | Joback Calculated Property |
| η | 0.0000476 | Pa×s | 776.95 | Joback Calculated Property |
| η | 0.0000301 | Pa×s | 855.12 | Joback Calculated Property |
| η | 0.0000206 | Pa×s | 933.28 | Joback Calculated Property |
| η | 0.0000149 | Pa×s | 1011.44 | Joback Calculated Property |
| η | 0.0000113 | Pa×s | 1089.60 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phthalic acid, octadecyl pent-4-enyl ester.
Sources
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