- InChI
- InChI=1S/C24H30O4/c1-2-3-4-5-6-10-17-27-23(25)21-14-11-15-22(19-21)24(26)28-18-16-20-12-8-7-9-13-20/h7-9,11-15,19H,2-6,10,16-18H2,1H3
- InChI Key
- FZVHQJTUQGLRRX-UHFFFAOYSA-N
- Formula
- C24H30O4
- SMILES
-
CCCCCCCCOC(=O)c1cccc(C(=O)OCCc
2ccccc2)c1 - Molecular Weight1
- 382.49
- 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 | 1.0599 | Relay (1.0) Calculated Property | |
| ΔfG° | -254.35 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -677.64 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 54.35 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 115.28 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.78 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.66 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.603 | Crippen Calculated Property | |
| McVol | 316.380 | ml/mol | McGowan Calculated Property |
| Pc | 1218.29 | kPa | Joback Calculated Property |
| Inp | [3102.00; 3102.00] |
|
|
| Inp | 3102.00 | NIST | |
| Inp | 3102.00 | NIST | |
| Tboil | 694.69 | K | Relay (1.0) Calculated Property |
| Tc | 926.52 | K | Relay (1.0) Calculated Property |
| Tfus | 284.72 | K | Relay (1.0) Calculated Property |
| Vc | 1.182 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1004.46; 1071.53] | J/mol×K | [923.50; 1140.81] |
|
| Cp,gas | 1004.46 | J/mol×K | 923.50 | Joback Calculated Property |
| Cp,gas | 1019.08 | J/mol×K | 959.72 | Joback Calculated Property |
| Cp,gas | 1032.25 | J/mol×K | 995.94 | Joback Calculated Property |
| Cp,gas | 1044.03 | J/mol×K | 1032.15 | Joback Calculated Property |
| Cp,gas | 1054.47 | J/mol×K | 1068.37 | Joback Calculated Property |
| Cp,gas | 1063.62 | J/mol×K | 1104.59 | Joback Calculated Property |
| Cp,gas | 1071.53 | J/mol×K | 1140.81 | Joback Calculated Property |
| η | [0.0000241; 0.0004601] | Pa×s | [510.26; 923.50] |
|
| η | 0.0004601 | Pa×s | 510.26 | Joback Calculated Property |
| η | 0.0002100 | Pa×s | 579.13 | Joback Calculated Property |
| η | 0.0001132 | Pa×s | 648.01 | Joback Calculated Property |
| η | 0.0000688 | Pa×s | 716.88 | Joback Calculated Property |
| η | 0.0000456 | Pa×s | 785.75 | Joback Calculated Property |
| η | 0.0000323 | Pa×s | 854.63 | Joback Calculated Property |
| η | 0.0000241 | Pa×s | 923.50 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isophthalic acid, octyl phenylethyl ester.
Sources
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