- InChI
- InChI=1S/C15H12Cl2O2/c16-13-8-7-12(10-14(13)17)19-15(18)9-6-11-4-2-1-3-5-11/h1-5,7-8,10H,6,9H2
- InChI Key
- FQOCOCXQBBVPNZ-UHFFFAOYSA-N
- Formula
- C15H12Cl2O2
- SMILES
-
O=C(CCc1ccccc1)Oc1ccc(Cl)c(Cl)
c1 - Molecular Weight1
- 295.16
- 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° | 23.20 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -179.09 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.09 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 72.79 | kJ/mol | Joback Calculated Property |
| log10WS | -5.19 | Crippen Calculated Property | |
| logPoct/wat | 4.532 | Crippen Calculated Property | |
| McVol | 206.610 | ml/mol | McGowan Calculated Property |
| Pc | 2370.28 | kPa | Joback Calculated Property |
| Inp | 2177.00 | NIST | |
| Tboil | 757.07 | K | Joback Calculated Property |
| Tc | 1001.10 | K | Joback Calculated Property |
| Tfus | 468.69 | K | Joback Calculated Property |
| Vc | 0.781 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [513.29; 574.32] | J/mol×K | [757.07; 1001.10] | 
|
| Cp,gas | 513.29 | J/mol×K | 757.07 | Joback Calculated Property |
| Cp,gas | 526.09 | J/mol×K | 797.74 | Joback Calculated Property |
| Cp,gas | 537.77 | J/mol×K | 838.41 | Joback Calculated Property |
| Cp,gas | 548.39 | J/mol×K | 879.08 | Joback Calculated Property |
| Cp,gas | 557.99 | J/mol×K | 919.75 | Joback Calculated Property |
| Cp,gas | 566.61 | J/mol×K | 960.43 | Joback Calculated Property |
| Cp,gas | 574.32 | J/mol×K | 1001.10 | Joback Calculated Property |
| η | [0.0001143; 0.0008024] | Pa×s | [468.69; 757.07] |
|
| η | 0.0008024 | Pa×s | 468.69 | Joback Calculated Property |
| η | 0.0004986 | Pa×s | 516.75 | Joback Calculated Property |
| η | 0.0003359 | Pa×s | 564.82 | Joback Calculated Property |
| η | 0.0002408 | Pa×s | 612.88 | Joback Calculated Property |
| η | 0.0001811 | Pa×s | 660.94 | Joback Calculated Property |
| η | 0.0001416 | Pa×s | 709.01 | Joback Calculated Property |
| η | 0.0001143 | Pa×s | 757.07 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Phenylpropionic acid, 3,4-dichlorophenyl ester.
Sources
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