- InChI
- InChI=1S/C3H5ClO/c1-3(4)2-5/h5H,1-2H2
- InChI Key
- OSCXYTRISGREIM-UHFFFAOYSA-N
- Formula
- C3H5ClO
- SMILES
- C=C(Cl)CO
- Molecular Weight1
- 92.52
- CAS
- 5976-47-6
- Other Names
-
- «beta»-Chloroallyl alcohol
- 2-Chloro-2-propenol
- 2-Chloroallyl alcohol
- 2-Propen-1-ol, 2-chloro-
- 2-Chloro-3-hydroxypropene
- 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° | -95.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -157.58 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 9.22 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 42.75 | kJ/mol | Joback Calculated Property |
| log10WS | -0.84 | Crippen Calculated Property | |
| logPoct/wat | 0.731 | Crippen Calculated Property | |
| McVol | 66.940 | ml/mol | McGowan Calculated Property |
| Pc | 5073.01 | kPa | Joback Calculated Property |
| Tboil | [406.70; 411.20] | K |
|
| Tboil | 406.70 | K | NIST |
| Tboil | 411.20 | K | NIST |
| Tc | 571.26 | K | Joback Calculated Property |
| Tfus | 198.59 | K | Joback Calculated Property |
| Vc | 0.254 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [108.02; 133.82] | J/mol×K | [394.21; 571.26] |
|
| Cp,gas | 108.02 | J/mol×K | 394.21 | Joback Calculated Property |
| Cp,gas | 112.88 | J/mol×K | 423.72 | Joback Calculated Property |
| Cp,gas | 117.51 | J/mol×K | 453.23 | Joback Calculated Property |
| Cp,gas | 121.90 | J/mol×K | 482.74 | Joback Calculated Property |
| Cp,gas | 126.08 | J/mol×K | 512.24 | Joback Calculated Property |
| Cp,gas | 130.05 | J/mol×K | 541.75 | Joback Calculated Property |
| Cp,gas | 133.82 | J/mol×K | 571.26 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Chloro-2-propen-1-ol.
Sources
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