- InChI
- InChI=1S/C4H7ClS/c1-3(5)4-2-6-4/h3-4H,2H2,1H3
- InChI Key
- WOIHFPJCIFTANY-UHFFFAOYSA-N
- Formula
- C4H7ClS
- SMILES
- CC(Cl)C1CS1
- Molecular Weight1
- 122.62
- 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).
- 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° | 69.04 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -28.85 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 8.58 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 34.22 | kJ/mol | Joback Calculated Property |
| log10WS | -1.65 | Crippen Calculated Property | |
| logPoct/wat | 1.729 | Crippen Calculated Property | |
| McVol | 84.950 | ml/mol | McGowan Calculated Property |
| Pc | 4403.25 | kPa | Joback Calculated Property |
| Inp | 858.00 | NIST | |
| Tboil | 382.48 | K | Joback Calculated Property |
| Tc | 595.22 | K | Joback Calculated Property |
| Tfus | 251.15 | K | Joback Calculated Property |
| Vc | 0.305 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [138.74; 187.06] | J/mol×K | [382.48; 595.22] | 
|
| Cp,gas | 138.74 | J/mol×K | 382.48 | Joback Calculated Property |
| Cp,gas | 148.32 | J/mol×K | 417.94 | Joback Calculated Property |
| Cp,gas | 157.23 | J/mol×K | 453.39 | Joback Calculated Property |
| Cp,gas | 165.52 | J/mol×K | 488.85 | Joback Calculated Property |
| Cp,gas | 173.23 | J/mol×K | 524.31 | Joback Calculated Property |
| Cp,gas | 180.39 | J/mol×K | 559.77 | Joback Calculated Property |
| Cp,gas | 187.06 | J/mol×K | 595.22 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Thiirane, 2-(1-chloroethyl).
Sources
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