- InChI
- InChI=1S/C3H4S2/c1-2-4-5-3-1/h1-2H,3H2
- InChI Key
- PCGDBWLKAYKBTN-UHFFFAOYSA-N
- Formula
- C3H4S2
- SMILES
- C1=CSSC1
- Molecular Weight1
- 104.19
- CAS
- 288-26-6
- 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° | 128.32 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 123.87 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 4.93 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 34.75 | kJ/mol | Joback Calculated Property |
| log10WS | -2.08 | Crippen Calculated Property | |
| logPoct/wat | 1.895 | Crippen Calculated Property | |
| McVol | 70.670 | ml/mol | McGowan Calculated Property |
| Pc | 6209.79 | kPa | Joback Calculated Property |
| Inp | [936.00; 958.60] |
|
|
| Inp | 945.00 | NIST | |
| Inp | 945.00 | NIST | |
| Inp | 936.00 | NIST | |
| Inp | 958.60 | NIST | |
| Inp | 941.00 | NIST | |
| Inp | 936.00 | NIST | |
| Inp | 958.60 | NIST | |
| Inp | 941.00 | NIST | |
| I | [1490.00; 1513.00] |
|
|
| I | 1490.00 | NIST | |
| I | 1510.00 | NIST | |
| I | 1513.00 | NIST | |
| I | 1510.00 | NIST | |
| I | 1490.00 | NIST | |
| Tboil | 382.81 | K | Joback Calculated Property |
| Tc | 625.27 | K | Joback Calculated Property |
| Tfus | 306.37 | K | Joback Calculated Property |
| Vc | 0.224 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [101.43; 139.91] | J/mol×K | [382.81; 625.27] |
|
| Cp,gas | 101.43 | J/mol×K | 382.81 | Joback Calculated Property |
| Cp,gas | 109.35 | J/mol×K | 423.22 | Joback Calculated Property |
| Cp,gas | 116.60 | J/mol×K | 463.63 | Joback Calculated Property |
| Cp,gas | 123.24 | J/mol×K | 504.04 | Joback Calculated Property |
| Cp,gas | 129.31 | J/mol×K | 544.45 | Joback Calculated Property |
| Cp,gas | 134.85 | J/mol×K | 584.86 | Joback Calculated Property |
| Cp,gas | 139.91 | J/mol×K | 625.27 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Dithiacyclopent-3-ene.
Sources
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