- InChI
- InChI=1S/C4H5ClO2/c1-3(5)2-4(6)7/h1-2H2,(H,6,7)
- InChI Key
- OSNGODILMZETAE-UHFFFAOYSA-N
- Formula
- C4H5ClO2
- SMILES
- C=C(Cl)CC(=O)O
- Molecular Weight1
- 120.53
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- 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 | 0.5806 | Relay (1.0) Calculated Property | |
| ΔfG° | -215.58 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -372.61 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 13.41 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.95 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.59 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.41 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.214 | Crippen Calculated Property | |
| McVol | 82.600 | ml/mol | McGowan Calculated Property |
| Pc | 4842.69 | kPa | Joback Calculated Property |
| Tboil | 461.15 | K | Relay (1.0) Calculated Property |
| Tc | 668.45 | K | Relay (1.0) Calculated Property |
| Tfus | 293.73 | K | Relay (1.0) Calculated Property |
| Vc | 0.279 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [150.56; 179.76] | J/mol×K | [470.96; 658.06] | 
|
| Cp,gas | 150.56 | J/mol×K | 470.96 | Joback Calculated Property |
| Cp,gas | 156.13 | J/mol×K | 502.14 | Joback Calculated Property |
| Cp,gas | 161.40 | J/mol×K | 533.33 | Joback Calculated Property |
| Cp,gas | 166.39 | J/mol×K | 564.51 | Joback Calculated Property |
| Cp,gas | 171.10 | J/mol×K | 595.69 | Joback Calculated Property |
| Cp,gas | 175.56 | J/mol×K | 626.87 | Joback Calculated Property |
| Cp,gas | 179.76 | J/mol×K | 658.06 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cis-3-chlorocrotonic acid.
Sources
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