- InChI
- InChI=1S/C3H6OS/c1-2-3-5-4/h3H,2H2,1H3
- InChI Key
- BAZSXBOAXJLRNH-UHFFFAOYSA-N
- Formula
- C3H6OS
- SMILES
- CCC=S=O
- Molecular Weight1
- 90.14
- Other Names
-
- Thiopropanal S-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).
- 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° | -150.84 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -196.57 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 13.06 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 34.83 | kJ/mol | Joback Calculated Property |
| log10WS | -0.19 | Crippen Calculated Property | |
| logPoct/wat | 0.412 | Crippen Calculated Property | |
| McVol | 71.050 | ml/mol | McGowan Calculated Property |
| Pc | 5486.97 | kPa | Joback Calculated Property |
| Inp | [740.00; 760.00] |
|
|
| Inp | 740.00 | NIST | |
| Inp | 760.00 | NIST | |
| Tboil | 327.70 | K | Joback Calculated Property |
| Tc | 505.41 | K | Joback Calculated Property |
| Tfus | 173.88 | K | Joback Calculated Property |
| Vc | 0.275 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [103.23; 137.89] | J/mol×K | [327.70; 505.41] |
|
| Cp,gas | 103.23 | J/mol×K | 327.70 | Joback Calculated Property |
| Cp,gas | 109.90 | J/mol×K | 357.32 | Joback Calculated Property |
| Cp,gas | 116.19 | J/mol×K | 386.94 | Joback Calculated Property |
| Cp,gas | 122.12 | J/mol×K | 416.56 | Joback Calculated Property |
| Cp,gas | 127.70 | J/mol×K | 446.18 | Joback Calculated Property |
| Cp,gas | 132.95 | J/mol×K | 475.80 | Joback Calculated Property |
| Cp,gas | 137.89 | J/mol×K | 505.41 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Thiopropanal sulfoxide.
Sources
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