- InChI
- InChI=1S/C4H4Cl4O/c5-1-3(9)4(7,8)2-6/h1-2H2
- InChI Key
- FOKWGKSYBDIIRQ-UHFFFAOYSA-N
- Formula
- C4H4Cl4O
- SMILES
- O=C(CCl)C(Cl)(Cl)CCl
- Molecular Weight1
- 209.89
- 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.
- 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° | -191.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -310.18 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.09 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 47.49 | kJ/mol | Joback Calculated Property |
| log10WS | -2.00 | Crippen Calculated Property | |
| logPoct/wat | 2.207 | Crippen Calculated Property | |
| McVol | 117.750 | ml/mol | McGowan Calculated Property |
| Pc | 3594.25 | kPa | Joback Calculated Property |
| Inp | [1078.00; 1105.00] |
|
|
| Inp | 1078.00 | NIST | |
| Inp | 1093.00 | NIST | |
| Inp | 1096.00 | NIST | |
| Inp | 1105.00 | NIST | |
| Inp | 1078.00 | NIST | |
| Tboil | 491.28 | K | Joback Calculated Property |
| Tc | 713.40 | K | Joback Calculated Property |
| Tfus | 306.87 | K | Joback Calculated Property |
| Vc | 0.451 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [196.28; 227.71] | J/mol×K | [491.28; 713.40] |
|
| Cp,gas | 196.28 | J/mol×K | 491.28 | Joback Calculated Property |
| Cp,gas | 202.85 | J/mol×K | 528.30 | Joback Calculated Property |
| Cp,gas | 208.83 | J/mol×K | 565.32 | Joback Calculated Property |
| Cp,gas | 214.27 | J/mol×K | 602.34 | Joback Calculated Property |
| Cp,gas | 219.20 | J/mol×K | 639.36 | Joback Calculated Property |
| Cp,gas | 223.66 | J/mol×K | 676.38 | Joback Calculated Property |
| Cp,gas | 227.71 | J/mol×K | 713.40 | Joback Calculated Property |
| η | [0.0004230; 0.0041106] | Pa×s | [306.87; 491.28] |
|
| η | 0.0041106 | Pa×s | 306.87 | Joback Calculated Property |
| η | 0.0023680 | Pa×s | 337.61 | Joback Calculated Property |
| η | 0.0014956 | Pa×s | 368.34 | Joback Calculated Property |
| η | 0.0010139 | Pa×s | 399.07 | Joback Calculated Property |
| η | 0.0007267 | Pa×s | 429.81 | Joback Calculated Property |
| η | 0.0005445 | Pa×s | 460.54 | Joback Calculated Property |
| η | 0.0004230 | Pa×s | 491.28 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Butanone, 1,3,3,4-tetrachloro.
Sources
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