- InChI
- InChI=1S/C14H8Cl4O2/c1-7-2-4-8(5-3-7)14(19)20-13-10(16)6-9(15)11(17)12(13)18/h2-6H,1H3
- InChI Key
- SFJHLPXLDGAAAK-UHFFFAOYSA-N
- Formula
- C14H8Cl4O2
- SMILES
-
Cc1ccc(C(=O)Oc2c(Cl)cc(Cl)c(Cl
)c2Cl)cc1 - Molecular Weight1
- 350.02
- 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° | -37.97 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -224.34 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.73 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.32 | kJ/mol | Joback Calculated Property |
| log10WS | -6.77 | Crippen Calculated Property | |
| logPoct/wat | 5.828 | Crippen Calculated Property | |
| McVol | 217.000 | ml/mol | McGowan Calculated Property |
| Pc | 2318.07 | kPa | Joback Calculated Property |
| Inp | [2484.00; 2484.00] |
|
|
| Inp | 2484.00 | NIST | |
| Inp | 2484.00 | NIST | |
| Tboil | 823.99 | K | Joback Calculated Property |
| Tc | 1078.98 | K | Joback Calculated Property |
| Tfus | 554.82 | K | Joback Calculated Property |
| Vc | 0.824 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [496.61; 539.67] | J/mol×K | [823.99; 1078.98] |
|
| Cp,gas | 496.61 | J/mol×K | 823.99 | Joback Calculated Property |
| Cp,gas | 506.20 | J/mol×K | 866.49 | Joback Calculated Property |
| Cp,gas | 514.79 | J/mol×K | 908.99 | Joback Calculated Property |
| Cp,gas | 522.41 | J/mol×K | 951.48 | Joback Calculated Property |
| Cp,gas | 529.08 | J/mol×K | 993.98 | Joback Calculated Property |
| Cp,gas | 534.83 | J/mol×K | 1036.48 | Joback Calculated Property |
| Cp,gas | 539.67 | J/mol×K | 1078.98 | Joback Calculated Property |
| η | [0.0001056; 0.0004583] | Pa×s | [554.82; 823.99] |
|
| η | 0.0004583 | Pa×s | 554.82 | Joback Calculated Property |
| η | 0.0003275 | Pa×s | 599.68 | Joback Calculated Property |
| η | 0.0002452 | Pa×s | 644.54 | Joback Calculated Property |
| η | 0.0001906 | Pa×s | 689.40 | Joback Calculated Property |
| η | 0.0001528 | Pa×s | 734.27 | Joback Calculated Property |
| η | 0.0001257 | Pa×s | 779.13 | Joback Calculated Property |
| η | 0.0001056 | Pa×s | 823.99 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Methylbenzoic acid, 2,3,4,6-tetrachlorophenyl ester.
Sources
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