- InChI
- InChI=1S/C6H7Cl3O2/c1-2-3-4-11-5(10)6(7,8)9/h2H,1,3-4H2
- InChI Key
- JNUGOAAJACVGAL-UHFFFAOYSA-N
- Formula
- C6H7Cl3O2
- SMILES
- C=CCCOC(=O)C(Cl)(Cl)Cl
- Molecular Weight1
- 217.48
- 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.
- I : 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° | -179.39 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -342.51 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.98 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 49.30 | kJ/mol | Joback Calculated Property |
| log10WS | -2.61 | Crippen Calculated Property | |
| logPoct/wat | 2.476 | Crippen Calculated Property | |
| McVol | 135.260 | ml/mol | McGowan Calculated Property |
| Pc | 3093.29 | kPa | Joback Calculated Property |
| Inp | 1122.00 | NIST | |
| I | 1546.00 | NIST | |
| Tboil | 518.71 | K | Joback Calculated Property |
| Tc | 731.04 | K | Joback Calculated Property |
| Tfus | 319.96 | K | Joback Calculated Property |
| Vc | 0.512 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [257.64; 301.41] | J/mol×K | [518.71; 731.04] | 
|
| Cp,gas | 257.64 | J/mol×K | 518.71 | Joback Calculated Property |
| Cp,gas | 266.35 | J/mol×K | 554.10 | Joback Calculated Property |
| Cp,gas | 274.45 | J/mol×K | 589.49 | Joback Calculated Property |
| Cp,gas | 281.98 | J/mol×K | 624.88 | Joback Calculated Property |
| Cp,gas | 288.96 | J/mol×K | 660.26 | Joback Calculated Property |
| Cp,gas | 295.43 | J/mol×K | 695.65 | Joback Calculated Property |
| Cp,gas | 301.41 | J/mol×K | 731.04 | Joback Calculated Property |
| η | [0.0002907; 0.0029426] | Pa×s | [319.96; 518.71] |
|
| η | 0.0029426 | Pa×s | 319.96 | Joback Calculated Property |
| η | 0.0016695 | Pa×s | 353.09 | Joback Calculated Property |
| η | 0.0010439 | Pa×s | 386.21 | Joback Calculated Property |
| η | 0.0007030 | Pa×s | 419.34 | Joback Calculated Property |
| η | 0.0005016 | Pa×s | 452.46 | Joback Calculated Property |
| η | 0.0003748 | Pa×s | 485.59 | Joback Calculated Property |
| η | 0.0002907 | Pa×s | 518.71 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Buten-1-ol, trichloroacetate.
Sources
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