- InChI
- InChI=1S/C23H34O4/c1-4-5-6-7-8-9-10-11-12-16-26-22(24)20-14-13-15-21(17-20)23(25)27-18-19(2)3/h11-15,17,19H,4-10,16,18H2,1-3H3/b12-11+
- InChI Key
- MUNZIXKMPXSOOV-VAWYXSNFSA-N
- Formula
- C23H34O4
- SMILES
-
CCCCCCCCC=CCOC(=O)c1cccc(C(=O)
OCC(C)C)c1 - Molecular Weight1
- 374.51
- 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° | -144.50 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -670.65 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 51.23 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 87.61 | kJ/mol | Joback Calculated Property |
| log10WS | -7.01 | Crippen Calculated Property | |
| logPoct/wat | 5.963 | Crippen Calculated Property | |
| McVol | 321.750 | ml/mol | McGowan Calculated Property |
| Pc | 1142.89 | kPa | Joback Calculated Property |
| Inp | [2797.00; 2797.00] |
|
|
| Inp | 2797.00 | NIST | |
| Inp | 2797.00 | NIST | |
| Tboil | 913.60 | K | Joback Calculated Property |
| Tc | 1122.95 | K | Joback Calculated Property |
| Tfus | 512.15 | K | Joback Calculated Property |
| Vc | 1.238 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1030.92; 1112.05] | J/mol×K | [913.60; 1122.95] |
|
| Cp,gas | 1030.92 | J/mol×K | 913.60 | Joback Calculated Property |
| Cp,gas | 1047.33 | J/mol×K | 948.49 | Joback Calculated Property |
| Cp,gas | 1062.53 | J/mol×K | 983.38 | Joback Calculated Property |
| Cp,gas | 1076.55 | J/mol×K | 1018.28 | Joback Calculated Property |
| Cp,gas | 1089.45 | J/mol×K | 1053.17 | Joback Calculated Property |
| Cp,gas | 1101.27 | J/mol×K | 1088.06 | Joback Calculated Property |
| Cp,gas | 1112.05 | J/mol×K | 1122.95 | Joback Calculated Property |
| η | [0.0000285; 0.0004475] | Pa×s | [512.15; 913.60] |
|
| η | 0.0004475 | Pa×s | 512.15 | Joback Calculated Property |
| η | 0.0002170 | Pa×s | 579.06 | Joback Calculated Property |
| η | 0.0001222 | Pa×s | 645.97 | Joback Calculated Property |
| η | 0.0000767 | Pa×s | 712.88 | Joback Calculated Property |
| η | 0.0000521 | Pa×s | 779.78 | Joback Calculated Property |
| η | 0.0000376 | Pa×s | 846.69 | Joback Calculated Property |
| η | 0.0000285 | Pa×s | 913.60 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isophthalic acid, isobutyl undec-2-en-1-yl ester.
Sources
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