- InChI
- InChI=1S/C3H4Cl2O/c4-3(5)1-2-6/h1,6H,2H2
- InChI Key
- KJEGVVJINLACNZ-UHFFFAOYSA-N
- Formula
- C3H4Cl2O
- SMILES
- OCC=C(Cl)Cl
- Molecular Weight1
- 126.97
- CAS
- 3039-55-2
- 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).
- 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° | -114.63 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -181.53 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 14.90 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 47.76 | kJ/mol | Joback Calculated Property |
| log10WS | -1.49 | Crippen Calculated Property | |
| logPoct/wat | 1.298 | Crippen Calculated Property | |
| McVol | 79.180 | ml/mol | McGowan Calculated Property |
| Pc | 4883.38 | kPa | Joback Calculated Property |
| Tboil | 439.12 | K | Joback Calculated Property |
| Tc | 628.63 | K | Joback Calculated Property |
| Tfus | 225.19 | K | Joback Calculated Property |
| Vc | 0.301 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [125.20; 149.31] | J/mol×K | [439.12; 628.63] | 
|
| Cp,gas | 125.20 | J/mol×K | 439.12 | Joback Calculated Property |
| Cp,gas | 129.92 | J/mol×K | 470.70 | Joback Calculated Property |
| Cp,gas | 134.33 | J/mol×K | 502.29 | Joback Calculated Property |
| Cp,gas | 138.46 | J/mol×K | 533.87 | Joback Calculated Property |
| Cp,gas | 142.32 | J/mol×K | 565.46 | Joback Calculated Property |
| Cp,gas | 145.93 | J/mol×K | 597.04 | Joback Calculated Property |
| Cp,gas | 149.31 | J/mol×K | 628.63 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3,3-Dichloro-2-propene-1-ol.
Sources
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