- InChI
- InChI=1S/C18H24O6/c1-4-5-6-7-12-23-17(19)10-11-18(20)24-14-8-9-15(21-2)16(13-14)22-3/h8-11,13H,4-7,12H2,1-3H3/b11-10+
- InChI Key
- IQCCMXKQRJZZHR-ZHACJKMWSA-N
- Formula
- C18H24O6
- SMILES
-
CCCCCCOC(=O)C=CC(=O)Oc1ccc(OC)
c(OC)c1 - Molecular Weight1
- 336.38
- 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° | -403.79 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -838.08 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 43.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.35 | kJ/mol | Joback Calculated Property |
| log10WS | -4.09 | Crippen Calculated Property | |
| logPoct/wat | 3.289 | Crippen Calculated Property | |
| McVol | 263.040 | ml/mol | McGowan Calculated Property |
| Pc | 1556.12 | kPa | Joback Calculated Property |
| Inp | [2582.00; 2582.00] |
|
|
| Inp | 2582.00 | NIST | |
| Inp | 2582.00 | NIST | |
| Tboil | 849.46 | K | Joback Calculated Property |
| Tc | 1055.39 | K | Joback Calculated Property |
| Tfus | 527.78 | K | Joback Calculated Property |
| Vc | 1.000 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [791.06; 859.03] | J/mol×K | [849.46; 1055.39] |
|
| Cp,gas | 791.06 | J/mol×K | 849.46 | Joback Calculated Property |
| Cp,gas | 805.25 | J/mol×K | 883.78 | Joback Calculated Property |
| Cp,gas | 818.30 | J/mol×K | 918.10 | Joback Calculated Property |
| Cp,gas | 830.21 | J/mol×K | 952.42 | Joback Calculated Property |
| Cp,gas | 840.97 | J/mol×K | 986.74 | Joback Calculated Property |
| Cp,gas | 850.58 | J/mol×K | 1021.06 | Joback Calculated Property |
| Cp,gas | 859.03 | J/mol×K | 1055.39 | Joback Calculated Property |
| η | [0.0000362; 0.0002882] | Pa×s | [527.78; 849.46] |
|
| η | 0.0002882 | Pa×s | 527.78 | Joback Calculated Property |
| η | 0.0001738 | Pa×s | 581.39 | Joback Calculated Property |
| η | 0.0001142 | Pa×s | 635.01 | Joback Calculated Property |
| η | 0.0000801 | Pa×s | 688.62 | Joback Calculated Property |
| η | 0.0000591 | Pa×s | 742.23 | Joback Calculated Property |
| η | 0.0000455 | Pa×s | 795.85 | Joback Calculated Property |
| η | 0.0000362 | Pa×s | 849.46 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, 3,4-dimethylphenyl hexyl ester.
Sources
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