- InChI
- InChI=1S/C26H40O4/c1-3-5-7-8-9-10-11-12-13-14-18-22-30-26(28)24-20-16-15-19-23(24)25(27)29-21-17-6-4-2/h4,15-16,19-20H,2-3,5-14,17-18,21-22H2,1H3
- InChI Key
- IJWVSMQETQOBPD-UHFFFAOYSA-N
- Formula
- C26H40O4
- SMILES
-
C=CCCCOC(=O)c1ccccc1C(=O)OCCCC
CCCCCCCCC - Molecular Weight1
- 416.59
- 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 | 1.1846 | Relay (1.0) Calculated Property | |
| ΔfG° | -262.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -856.79 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 64.21 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 118.44 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.32 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.28 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.277 | Crippen Calculated Property | |
| McVol | 364.020 | ml/mol | McGowan Calculated Property |
| Pc | 893.20 | kPa | Joback Calculated Property |
| Inp | [2955.00; 2955.00] |
|
|
| Inp | 2955.00 | NIST | |
| Inp | 2955.00 | NIST | |
| Tboil | 698.71 | K | Relay (1.0) Calculated Property |
| Tc | 886.57 | K | Relay (1.0) Calculated Property |
| Tfus | 273.35 | K | Relay (1.0) Calculated Property |
| Vc | 1.355 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1198.23; 1279.63] | J/mol×K | [939.26; 1149.93] |
|
| Cp,gas | 1198.23 | J/mol×K | 939.26 | Joback Calculated Property |
| Cp,gas | 1215.30 | J/mol×K | 974.37 | Joback Calculated Property |
| Cp,gas | 1230.91 | J/mol×K | 1009.48 | Joback Calculated Property |
| Cp,gas | 1245.09 | J/mol×K | 1044.60 | Joback Calculated Property |
| Cp,gas | 1257.90 | J/mol×K | 1079.71 | Joback Calculated Property |
| Cp,gas | 1269.40 | J/mol×K | 1114.82 | Joback Calculated Property |
| Cp,gas | 1279.63 | J/mol×K | 1149.93 | Joback Calculated Property |
| η | [0.0000186; 0.0004421] | Pa×s | [504.62; 939.26] |
|
| η | 0.0004421 | Pa×s | 504.62 | Joback Calculated Property |
| η | 0.0001872 | Pa×s | 577.06 | Joback Calculated Property |
| η | 0.0000960 | Pa×s | 649.50 | Joback Calculated Property |
| η | 0.0000563 | Pa×s | 721.94 | Joback Calculated Property |
| η | 0.0000364 | Pa×s | 794.38 | Joback Calculated Property |
| η | 0.0000253 | Pa×s | 866.82 | Joback Calculated Property |
| η | 0.0000186 | Pa×s | 939.26 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phthalic acid, pent-4-enyl tridecyl ester.
Sources
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