- InChI
- InChI=1S/C18H24O5/c1-12(2)14(5)22-17(19)10-11-18(20)23-16-9-7-6-8-15(16)21-13(3)4/h6-14H,1-5H3/b11-10+
- InChI Key
- YXRVIAKLEYRIQT-ZHACJKMWSA-N
- Formula
- C18H24O5
- SMILES
-
CC(C)Oc1ccccc1OC(=O)C=CC(=O)OC
(C)C(C)C - Molecular Weight1
- 320.38
- 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° | -296.48 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -710.23 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 32.42 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.12 | kJ/mol | Joback Calculated Property |
| log10WS | -4.37 | Crippen Calculated Property | |
| logPoct/wat | 3.523 | Crippen Calculated Property | |
| McVol | 257.170 | ml/mol | McGowan Calculated Property |
| Pc | 1627.22 | kPa | Joback Calculated Property |
| Inp | [2108.00; 2108.00] |
|
|
| Inp | 2108.00 | NIST | |
| Inp | 2108.00 | NIST | |
| Tboil | 820.74 | K | Joback Calculated Property |
| Tc | 1032.97 | K | Joback Calculated Property |
| Tfus | 448.03 | K | Joback Calculated Property |
| Vc | 0.964 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [765.57; 839.84] | J/mol×K | [820.74; 1032.97] |
|
| Cp,gas | 765.57 | J/mol×K | 820.74 | Joback Calculated Property |
| Cp,gas | 780.83 | J/mol×K | 856.11 | Joback Calculated Property |
| Cp,gas | 794.92 | J/mol×K | 891.48 | Joback Calculated Property |
| Cp,gas | 807.84 | J/mol×K | 926.85 | Joback Calculated Property |
| Cp,gas | 819.63 | J/mol×K | 962.23 | Joback Calculated Property |
| Cp,gas | 830.29 | J/mol×K | 997.60 | Joback Calculated Property |
| Cp,gas | 839.84 | J/mol×K | 1032.97 | Joback Calculated Property |
| η | [0.0000366; 0.0007175] | Pa×s | [448.03; 820.74] |
|
| η | 0.0007175 | Pa×s | 448.03 | Joback Calculated Property |
| η | 0.0003231 | Pa×s | 510.15 | Joback Calculated Property |
| η | 0.0001730 | Pa×s | 572.27 | Joback Calculated Property |
| η | 0.0001047 | Pa×s | 634.38 | Joback Calculated Property |
| η | 0.0000693 | Pa×s | 696.50 | Joback Calculated Property |
| η | 0.0000491 | Pa×s | 758.62 | Joback Calculated Property |
| η | 0.0000366 | Pa×s | 820.74 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, 2-isopropoxyphenyl 3-methylbut-2-yl ester.
Sources
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