- InChI
- InChI=1S/C5H10O2S/c1-4-2-6-5(3-8)7-4/h4-5,8H,2-3H2,1H3/t4-,5-/m0/s1
- InChI Key
- IZIJAPPJBKUSNQ-WHFBIAKZSA-N
- Formula
- C5H10O2S
- SMILES
- CC1COC(CS)O1
- Molecular Weight1
- 134.20
- 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.
- I : 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° | -122.79 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -331.91 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 23.71 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 42.43 | kJ/mol | Joback Calculated Property |
| log10WS | -0.78 | Crippen Calculated Property | |
| logPoct/wat | 0.678 | Crippen Calculated Property | |
| McVol | 98.540 | ml/mol | McGowan Calculated Property |
| Pc | 4414.96 | kPa | Joback Calculated Property |
| Inp | 959.00 | NIST | |
| I | 1476.00 | NIST | |
| Tboil | 441.17 | K | Joback Calculated Property |
| Tc | 665.59 | K | Joback Calculated Property |
| Tfus | 242.37 | K | Joback Calculated Property |
| Vc | 0.351 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [203.21; 270.86] | J/mol×K | [441.17; 665.59] | 
|
| Cp,gas | 203.21 | J/mol×K | 441.17 | Joback Calculated Property |
| Cp,gas | 216.16 | J/mol×K | 478.57 | Joback Calculated Property |
| Cp,gas | 228.42 | J/mol×K | 515.98 | Joback Calculated Property |
| Cp,gas | 240.00 | J/mol×K | 553.38 | Joback Calculated Property |
| Cp,gas | 250.93 | J/mol×K | 590.78 | Joback Calculated Property |
| Cp,gas | 261.21 | J/mol×K | 628.18 | Joback Calculated Property |
| Cp,gas | 270.86 | J/mol×K | 665.59 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to trans-2-(mercaptomethyl)-4-methyl-1,3-dioxolane.
Sources
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