- InChI
- InChI=1S/C8H6Cl2O2/c1-4(11)6-2-5(9)3-7(10)8(6)12/h2-3,12H,1H3
- InChI Key
- CJFYGRLJDKWMDI-UHFFFAOYSA-N
- Formula
- C8H6Cl2O2
- SMILES
- CC(=O)c1cc(Cl)cc(Cl)c1O
- Molecular Weight1
- 205.04
- CAS
- 3321-92-4
- Other Names
-
- Ethanone, 1-(3,5-dichloro-2-hydroxyphenyl)-
- Acetophenone, 3',5'-dichloro-2'-hydroxy-
- 2'-Hydroxy-3',5'-dichloroacetophenone
- 2-Acetyl-4,6-dichlorophenol
- 3',5'-Dichloro-2'-hydroxyacetophenone
- 4,6-Dichloro-2-acetylphenol
- 1-(3,5-Dichloro-2-hydroxy-phenyl)-ethanone
- 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° | -197.77 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -316.23 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 25.52 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 65.53 | kJ/mol | Joback Calculated Property |
| log10WS | -3.05 | Crippen Calculated Property | |
| logPoct/wat | 2.902 | Crippen Calculated Property | |
| McVol | 131.740 | ml/mol | McGowan Calculated Property |
| Pc | 4178.49 | kPa | Joback Calculated Property |
| Tboil | 628.43 | K | Joback Calculated Property |
| Tc | 873.32 | K | Joback Calculated Property |
| Tfus | 452.87 | K | Joback Calculated Property |
| Vc | 0.446 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [276.54; 317.90] | J/mol×K | [628.43; 873.32] | 
|
| Cp,gas | 276.54 | J/mol×K | 628.43 | Joback Calculated Property |
| Cp,gas | 284.67 | J/mol×K | 669.25 | Joback Calculated Property |
| Cp,gas | 292.20 | J/mol×K | 710.06 | Joback Calculated Property |
| Cp,gas | 299.21 | J/mol×K | 750.88 | Joback Calculated Property |
| Cp,gas | 305.77 | J/mol×K | 791.69 | Joback Calculated Property |
| Cp,gas | 311.97 | J/mol×K | 832.51 | Joback Calculated Property |
| Cp,gas | 317.90 | J/mol×K | 873.32 | Joback Calculated Property |
| η | [0.0000400; 0.0005001] | Pa×s | [452.87; 628.43] |
|
| η | 0.0005001 | Pa×s | 452.87 | Joback Calculated Property |
| η | 0.0002888 | Pa×s | 482.13 | Joback Calculated Property |
| η | 0.0001776 | Pa×s | 511.39 | Joback Calculated Property |
| η | 0.0001151 | Pa×s | 540.65 | Joback Calculated Property |
| η | 0.0000780 | Pa×s | 569.91 | Joback Calculated Property |
| η | 0.0000549 | Pa×s | 599.17 | Joback Calculated Property |
| η | 0.0000400 | Pa×s | 628.43 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3,5-Dichloro-2-hydroxyacetophenone.
Sources
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