- InChI
- InChI=1S/C19H25ClO4/c1-16-10-6-7-11-17(16)24-19(22)13-12-18(21)23-15-9-5-3-2-4-8-14-20/h6-7,10-13H,2-5,8-9,14-15H2,1H3/b13-12+
- InChI Key
- WYVTYMQROJTVCV-OUKQBFOZSA-N
- Formula
- C19H25ClO4
- SMILES
-
Cc1ccccc1OC(=O)C=CC(=O)OCCCCCC
CCCl - Molecular Weight1
- 352.85
- 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° | -187.67 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -598.55 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 48.59 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 83.48 | kJ/mol | Joback Calculated Property |
| log10WS | -5.32 | Crippen Calculated Property | |
| logPoct/wat | 4.579 | Crippen Calculated Property | |
| McVol | 277.630 | ml/mol | McGowan Calculated Property |
| Pc | 1457.90 | kPa | Joback Calculated Property |
| Inp | [2667.00; 2667.00] |
|
|
| Inp | 2667.00 | NIST | |
| Inp | 2667.00 | NIST | |
| Tboil | 859.95 | K | Joback Calculated Property |
| Tc | 1068.62 | K | Joback Calculated Property |
| Tfus | 511.99 | K | Joback Calculated Property |
| Vc | 1.069 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [819.34; 890.22] | J/mol×K | [859.95; 1068.62] |
|
| Cp,gas | 819.34 | J/mol×K | 859.95 | Joback Calculated Property |
| Cp,gas | 833.64 | J/mol×K | 894.73 | Joback Calculated Property |
| Cp,gas | 846.90 | J/mol×K | 929.51 | Joback Calculated Property |
| Cp,gas | 859.15 | J/mol×K | 964.29 | Joback Calculated Property |
| Cp,gas | 870.43 | J/mol×K | 999.06 | Joback Calculated Property |
| Cp,gas | 880.77 | J/mol×K | 1033.84 | Joback Calculated Property |
| Cp,gas | 890.22 | J/mol×K | 1068.62 | Joback Calculated Property |
| η | [0.0000476; 0.0004963] | Pa×s | [511.99; 859.95] |
|
| η | 0.0004963 | Pa×s | 511.99 | Joback Calculated Property |
| η | 0.0002753 | Pa×s | 569.98 | Joback Calculated Property |
| η | 0.0001703 | Pa×s | 627.98 | Joback Calculated Property |
| η | 0.0001142 | Pa×s | 685.97 | Joback Calculated Property |
| η | 0.0000815 | Pa×s | 743.96 | Joback Calculated Property |
| η | 0.0000611 | Pa×s | 801.96 | Joback Calculated Property |
| η | 0.0000476 | Pa×s | 859.95 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, 2-methylphenyl 8-chlorooctyl ester.
Sources
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