- InChI
- InChI=1S/C8H6Cl2O/c9-8(10)7(11)6-4-2-1-3-5-6/h1-5,8H
- InChI Key
- CERJZAHSUZVMCH-UHFFFAOYSA-N
- Formula
- C8H6Cl2O
- SMILES
- O=C(c1ccccc1)C(Cl)Cl
- Molecular Weight1
- 189.04
- Other Names
-
- 2,2-Dichloroacetophenone
- «omega»,«omega»-Dichloroacetophenone
- Acetophenone, 2,2-dichloro-
- Ethanone, 2,2-dichloro-1-phenyl-
- Phenacylidene chloride
- 1,1-Dichloroacetophenone
- ω : Acentric Factor.
- 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).
- 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).
- Tboilr : Boiling point at reduced pressure (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 | 0.4008 | Relay (1.0) Calculated Property | |
| ΔfG° | -26.33 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -122.34 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 16.99 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.94 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.61 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.72 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.673 | Crippen Calculated Property | |
| McVol | 125.870 | ml/mol | McGowan Calculated Property |
| Pc | 3637.73 | kPa | Joback Calculated Property |
| Tboil | 522.20 | K | NIST |
| Tc | 764.03 | K | Relay (1.0) Calculated Property |
| Tfus | 331.73 | K | Relay (1.0) Calculated Property |
| Vc | 0.443 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [239.90; 291.37] | J/mol×K | [537.61; 775.72] | 
|
| Cp,gas | 239.90 | J/mol×K | 537.61 | Joback Calculated Property |
| Cp,gas | 250.41 | J/mol×K | 577.30 | Joback Calculated Property |
| Cp,gas | 260.09 | J/mol×K | 616.98 | Joback Calculated Property |
| Cp,gas | 268.98 | J/mol×K | 656.67 | Joback Calculated Property |
| Cp,gas | 277.13 | J/mol×K | 696.35 | Joback Calculated Property |
| Cp,gas | 284.58 | J/mol×K | 736.04 | Joback Calculated Property |
| Cp,gas | 291.37 | J/mol×K | 775.72 | Joback Calculated Property |
| η | [0.0002909; 0.0036093] | Pa×s | [301.11; 537.61] |
|
| η | 0.0036093 | Pa×s | 301.11 | Joback Calculated Property |
| η | 0.0018605 | Pa×s | 340.53 | Joback Calculated Property |
| η | 0.0011004 | Pa×s | 379.94 | Joback Calculated Property |
| η | 0.0007184 | Pa×s | 419.36 | Joback Calculated Property |
| η | 0.0005046 | Pa×s | 458.78 | Joback Calculated Property |
| η | 0.0003749 | Pa×s | 498.19 | Joback Calculated Property |
| η | 0.0002909 | Pa×s | 537.61 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 406.20 | K | 1.70 | NIST |
Similar Compounds
Find more compounds similar to 2,2-DICHLOROACETOPHENONE.
Sources
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