- InChI
- InChI=1S/C4H7ClS/c1-4(2-5)3-6-4/h2-3H2,1H3
- InChI Key
- RYVLXOUOFMZVRE-UHFFFAOYSA-N
- Formula
- C4H7ClS
- SMILES
- CC1(CCl)CS1
- 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° | 65.99 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -8.33 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 5.81 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 33.46 | kJ/mol | Joback Calculated Property |
| log10WS | -1.54 | Crippen Calculated Property | |
| logPoct/wat | 1.731 | Crippen Calculated Property | |
| McVol | 84.950 | ml/mol | McGowan Calculated Property |
| Pc | 4627.70 | kPa | Joback Calculated Property |
| Inp | 861.00 | NIST | |
| Tboil | 383.16 | K | Joback Calculated Property |
| Tc | 600.60 | K | Joback Calculated Property |
| Tfus | 290.05 | K | Joback Calculated Property |
| Vc | 0.309 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [139.27; 185.19] | J/mol×K | [383.16; 600.60] | 
|
| Cp,gas | 139.27 | J/mol×K | 383.16 | Joback Calculated Property |
| Cp,gas | 149.24 | J/mol×K | 419.40 | Joback Calculated Property |
| Cp,gas | 158.11 | J/mol×K | 455.64 | Joback Calculated Property |
| Cp,gas | 166.01 | J/mol×K | 491.88 | Joback Calculated Property |
| Cp,gas | 173.07 | J/mol×K | 528.12 | Joback Calculated Property |
| Cp,gas | 179.42 | J/mol×K | 564.36 | Joback Calculated Property |
| Cp,gas | 185.19 | J/mol×K | 600.60 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Thiirane, 2-methyl-2-chloromethyl.
Sources
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