- InChI
- InChI=1S/C9H8Cl2O2/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1,3,5H,2,4H2,(H,12,13)
- InChI Key
- NHYJRLYFKZYPMO-UHFFFAOYSA-N
- Formula
- C9H8Cl2O2
- SMILES
- O=C(O)CCc1ccc(Cl)c(Cl)c1
- Molecular Weight1
- 219.06
- CAS
- 25173-68-6
- 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).
- 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° | -171.55 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -311.79 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 26.41 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.42 | kJ/mol | Joback Calculated Property |
| log10WS | -3.16 | Crippen Calculated Property | |
| logPoct/wat | 3.011 | Crippen Calculated Property | |
| McVol | 145.830 | ml/mol | McGowan Calculated Property |
| Pc | 3460.21 | kPa | Joback Calculated Property |
| Tboil | 662.87 | K | Joback Calculated Property |
| Tc | 875.40 | K | Joback Calculated Property |
| Tfus | 413.24 | K | Joback Calculated Property |
| Vc | 0.554 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [322.70; 365.81] | J/mol×K | [662.87; 875.40] | 
|
| Cp,gas | 322.70 | J/mol×K | 662.87 | Joback Calculated Property |
| Cp,gas | 331.22 | J/mol×K | 698.29 | Joback Calculated Property |
| Cp,gas | 339.18 | J/mol×K | 733.71 | Joback Calculated Property |
| Cp,gas | 346.59 | J/mol×K | 769.13 | Joback Calculated Property |
| Cp,gas | 353.49 | J/mol×K | 804.56 | Joback Calculated Property |
| Cp,gas | 359.88 | J/mol×K | 839.98 | Joback Calculated Property |
| Cp,gas | 365.81 | J/mol×K | 875.40 | Joback Calculated Property |
| η | [0.0000756; 0.0016703] | Pa×s | [413.24; 662.87] |
|
| η | 0.0016703 | Pa×s | 413.24 | Joback Calculated Property |
| η | 0.0007875 | Pa×s | 454.85 | Joback Calculated Property |
| η | 0.0004211 | Pa×s | 496.45 | Joback Calculated Property |
| η | 0.0002481 | Pa×s | 538.06 | Joback Calculated Property |
| η | 0.0001577 | Pa×s | 579.66 | Joback Calculated Property |
| η | 0.0001065 | Pa×s | 621.26 | Joback Calculated Property |
| η | 0.0000756 | Pa×s | 662.87 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-(3,4-Dichlorophenyl)propionic acid.
Sources
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