- InChI
- InChI=1S/C4H4Cl2/c1-3(5)4(2)6/h1-2H2
- InChI Key
- LIFLRQVHKGGNSG-UHFFFAOYSA-N
- Formula
- C4H4Cl2
- SMILES
- C=C(Cl)C(=C)Cl
- Molecular Weight1
- 122.98
- ω : Acentric Factor.
- 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).
- 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).
- 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 | 0.2708 | Relay (1.0) Calculated Property | |
| ΔfG° | 117.52 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 52.00 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 9.33 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 28.70 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.18 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.91 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.491 | Crippen Calculated Property | |
| McVol | 83.100 | ml/mol | McGowan Calculated Property |
| Pc | 3995.65 | kPa | Joback Calculated Property |
| Tboil | 382.82 | K | Relay (1.0) Calculated Property |
| Tc | 583.12 | K | Relay (1.0) Calculated Property |
| Tfus | 273.52 | K | Relay (1.0) Calculated Property |
| Vc | 0.309 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [115.45; 146.27] | J/mol×K | [358.90; 557.15] | 
|
| Cp,gas | 115.45 | J/mol×K | 358.90 | Joback Calculated Property |
| Cp,gas | 121.48 | J/mol×K | 391.94 | Joback Calculated Property |
| Cp,gas | 127.12 | J/mol×K | 424.98 | Joback Calculated Property |
| Cp,gas | 132.40 | J/mol×K | 458.03 | Joback Calculated Property |
| Cp,gas | 137.34 | J/mol×K | 491.07 | Joback Calculated Property |
| Cp,gas | 141.96 | J/mol×K | 524.11 | Joback Calculated Property |
| Cp,gas | 146.27 | J/mol×K | 557.15 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,3-Dichloro-1,3-butadiene.
Sources
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