- InChI
- InChI=1S/C19H24O4/c20-18(22-14-13-16-7-3-1-4-8-16)11-12-19(21)23-15-17-9-5-2-6-10-17/h1,3-4,7-8,11-12,17H,2,5-6,9-10,13-15H2/b12-11+
- InChI Key
- GZUJZOLYRPCMPI-VAWYXSNFSA-N
- Formula
- C19H24O4
- SMILES
-
O=C(C=CC(=O)OCC1CCCCC1)OCCc1cc
ccc1 - Molecular Weight1
- 316.39
- 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° | -141.66 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -517.02 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 36.62 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.86 | kJ/mol | Joback Calculated Property |
| log10WS | -4.11 | Crippen Calculated Property | |
| logPoct/wat | 3.452 | Crippen Calculated Property | |
| McVol | 254.530 | ml/mol | McGowan Calculated Property |
| Pc | 1792.42 | kPa | Joback Calculated Property |
| Inp | [2477.00; 2477.00] |
|
|
| Inp | 2477.00 | NIST | |
| Inp | 2477.00 | NIST | |
| Tboil | 837.09 | K | Joback Calculated Property |
| Tc | 1063.77 | K | Joback Calculated Property |
| Tfus | 476.93 | K | Joback Calculated Property |
| Vc | 0.953 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [788.38; 868.34] | J/mol×K | [837.09; 1063.77] |
|
| Cp,gas | 788.38 | J/mol×K | 837.09 | Joback Calculated Property |
| Cp,gas | 805.10 | J/mol×K | 874.87 | Joback Calculated Property |
| Cp,gas | 820.39 | J/mol×K | 912.65 | Joback Calculated Property |
| Cp,gas | 834.30 | J/mol×K | 950.43 | Joback Calculated Property |
| Cp,gas | 846.89 | J/mol×K | 988.21 | Joback Calculated Property |
| Cp,gas | 858.22 | J/mol×K | 1025.99 | Joback Calculated Property |
| Cp,gas | 868.34 | J/mol×K | 1063.77 | Joback Calculated Property |
| η | [0.0000562; 0.0008187] | Pa×s | [476.93; 837.09] |
|
| η | 0.0008187 | Pa×s | 476.93 | Joback Calculated Property |
| η | 0.0004081 | Pa×s | 536.96 | Joback Calculated Property |
| η | 0.0002340 | Pa×s | 596.98 | Joback Calculated Property |
| η | 0.0001486 | Pa×s | 657.01 | Joback Calculated Property |
| η | 0.0001017 | Pa×s | 717.04 | Joback Calculated Property |
| η | 0.0000739 | Pa×s | 777.06 | Joback Calculated Property |
| η | 0.0000562 | Pa×s | 837.09 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, 2-phenethyl cyclohexylmethyl ester.
Sources
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