- InChI
- InChI=1S/C32H52O4/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-20-24-28-36-32(34)30-26-22-21-25-29(30)31(33)35-27-23-8-6-4-2/h6,8,21-22,25-26H,3-5,7,9-20,23-24,27-28H2,1-2H3/b8-6+
- InChI Key
- YAPKMXPAPDIWEF-SOFGYWHQSA-N
- Formula
- C32H52O4
- SMILES
-
CCC=CCCOC(=O)c1ccccc1C(=O)OCCC
CCCCCCCCCCCCCCC - Molecular Weight1
- 500.75
- 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 | 1.3559 | Relay (... Calculated Property | |
| ΔfG° | -66.28 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1003.73 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 78.06 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 140.89 | kJ/mol | Relay (... Calculated Property |
| IE | 9.22 | eV | Relay (... Calculated Property |
| log10WS | -8.98 | Relay (... Calculated Property | |
| logPoct/wat | 9.618 | Crippen Calculated Property | |
| McVol | 448.560 | ml/mol | McGowan Calculated Property |
| Pc | 681.71 | kPa | Joback Calculated Property |
| Inp | 3563.00 | NIST | |
| Tboil | 717.30 | K | Relay (... Calculated Property |
| Tc | 917.60 | K | Relay (... Calculated Property |
| Tfus | 274.05 | K | Relay (... Calculated Property |
| Vc | 1.673 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1596.66; 1689.69] | J/mol×K | [1119.96; 1395.96] | 
|
| Cp,gas | 1596.66 | J/mol×K | 1119.96 | Joback Calculated Property |
| Cp,gas | 1616.80 | J/mol×K | 1165.96 | Joback Calculated Property |
| Cp,gas | 1634.86 | J/mol×K | 1211.96 | Joback Calculated Property |
| Cp,gas | 1651.01 | J/mol×K | 1257.96 | Joback Calculated Property |
| Cp,gas | 1665.42 | J/mol×K | 1303.96 | Joback Calculated Property |
| Cp,gas | 1678.25 | J/mol×K | 1349.96 | Joback Calculated Property |
| Cp,gas | 1689.69 | J/mol×K | 1395.96 | Joback Calculated Property |
| η | [0.0000078; 0.0001296] | Pa×s | [628.58; 1119.96] |
|
| η | 0.0001296 | Pa×s | 628.58 | Joback Calculated Property |
| η | 0.0000620 | Pa×s | 710.48 | Joback Calculated Property |
| η | 0.0000346 | Pa×s | 792.37 | Joback Calculated Property |
| η | 0.0000215 | Pa×s | 874.27 | Joback Calculated Property |
| η | 0.0000145 | Pa×s | 956.17 | Joback Calculated Property |
| η | 0.0000104 | Pa×s | 1038.06 | Joback Calculated Property |
| η | 0.0000078 | Pa×s | 1119.96 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phthalic acid, octadecyl trans-hex-3-enyl ester.
Sources
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