- InChI
- InChI=1S/C15H12Cl2O2/c1-2-10-3-5-11(6-4-10)15(18)19-12-7-8-13(16)14(17)9-12/h3-9H,2H2,1H3
- InChI Key
- UHVGMXBIDBHYKS-UHFFFAOYSA-N
- Formula
- C15H12Cl2O2
- SMILES
-
CCc1ccc(C(=O)Oc2ccc(Cl)c(Cl)c2
)cc1 - Molecular Weight1
- 295.16
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.6952 | Relay (1.0) Calculated Property | |
| ΔfG° | 13.57 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -282.07 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 32.70 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 96.95 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.58 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.17 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.775 | Crippen Calculated Property | |
| McVol | 206.610 | ml/mol | McGowan Calculated Property |
| Pc | 2336.03 | kPa | Joback Calculated Property |
| Inp | 2251.00 | NIST | |
| Tboil | 622.15 | K | Relay (1.0) Calculated Property |
| Tc | 893.97 | K | Relay (1.0) Calculated Property |
| Tfus | 319.42 | K | Relay (1.0) Calculated Property |
| Vc | 0.745 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [511.80; 572.29] | J/mol×K | [762.05; 1006.83] | 
|
| Cp,gas | 511.80 | J/mol×K | 762.05 | Joback Calculated Property |
| Cp,gas | 524.49 | J/mol×K | 802.85 | Joback Calculated Property |
| Cp,gas | 536.08 | J/mol×K | 843.64 | Joback Calculated Property |
| Cp,gas | 546.62 | J/mol×K | 884.44 | Joback Calculated Property |
| Cp,gas | 556.14 | J/mol×K | 925.24 | Joback Calculated Property |
| Cp,gas | 564.68 | J/mol×K | 966.03 | Joback Calculated Property |
| Cp,gas | 572.29 | J/mol×K | 1006.83 | Joback Calculated Property |
| η | [0.0001150; 0.0006936] | Pa×s | [481.21; 762.05] |
|
| η | 0.0006936 | Pa×s | 481.21 | Joback Calculated Property |
| η | 0.0004502 | Pa×s | 528.02 | Joback Calculated Property |
| η | 0.0003135 | Pa×s | 574.82 | Joback Calculated Property |
| η | 0.0002305 | Pa×s | 621.63 | Joback Calculated Property |
| η | 0.0001770 | Pa×s | 668.44 | Joback Calculated Property |
| η | 0.0001406 | Pa×s | 715.24 | Joback Calculated Property |
| η | 0.0001150 | Pa×s | 762.05 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Ethylbenzoic acid, 3,4-dichlorophenyl ester.
Sources
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