- InChI
- InChI=1S/C4H8OS2/c5-7-3-1-6-2-4-7/h1-4H2
- InChI Key
- VBDLSQFQIUGPSA-UHFFFAOYSA-N
- Formula
- C4H8OS2
- SMILES
- O=S1CCSCC1
- Molecular Weight1
- 136.24
- CAS
- 19087-70-8
- Other Names
-
- p-Dithiane, 1-oxide
- 1,4-Dithiacyclohexane 1-oxide
- 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).
- 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° | -156.15 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -208.32 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 7.82 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 42.77 | kJ/mol | Joback Calculated Property |
| log10WS | 0.09 | Crippen Calculated Property | |
| logPoct/wat | 0.482 | Crippen Calculated Property | |
| McVol | 94.930 | ml/mol | McGowan Calculated Property |
| Pc | 5853.95 | kPa | Joback Calculated Property |
| Tboil | 400.30 | K | Joback Calculated Property |
| Tc | 628.72 | K | Joback Calculated Property |
| Tfus | 315.44 | K | Joback Calculated Property |
| Vc | 0.322 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [158.55; 221.45] | J/mol×K | [400.30; 628.72] | 
|
| Cp,gas | 158.55 | J/mol×K | 400.30 | Joback Calculated Property |
| Cp,gas | 170.82 | J/mol×K | 438.37 | Joback Calculated Property |
| Cp,gas | 182.34 | J/mol×K | 476.44 | Joback Calculated Property |
| Cp,gas | 193.14 | J/mol×K | 514.51 | Joback Calculated Property |
| Cp,gas | 203.24 | J/mol×K | 552.58 | Joback Calculated Property |
| Cp,gas | 212.67 | J/mol×K | 590.65 | Joback Calculated Property |
| Cp,gas | 221.45 | J/mol×K | 628.72 | Joback Calculated Property |
Similar Compounds
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Find more compounds similar to 1,4-Dithiane-1-oxide.
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