- InChI
- InChI=1S/C8H14O2S2/c1-3-7(9)5-11-12-6-8(10)4-2/h3-6H2,1-2H3
- InChI Key
- CHRHQBLBXBGDHK-UHFFFAOYSA-N
- Formula
- C8H14O2S2
- SMILES
- CCC(=O)CSSCC(=O)CC
- Molecular Weight1
- 206.33
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.5021 | Relay (1.0) Calculated Property | |
| ΔfG° | -175.12 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -396.41 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 27.93 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.22 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.73 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.89 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.326 | Crippen Calculated Property | |
| McVol | 159.420 | ml/mol | McGowan Calculated Property |
| Pc | 2999.15 | kPa | Joback Calculated Property |
| Inp | [1616.00; 1616.00] |
|
|
| Inp | 1616.00 | NIST | |
| Inp | 1616.00 | NIST | |
| Tboil | 548.30 | K | Relay (1.0) Calculated Property |
| Tc | 759.11 | K | Relay (1.0) Calculated Property |
| Tfus | 324.79 | K | Relay (1.0) Calculated Property |
| Vc | 0.550 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [373.79; 435.99] | J/mol×K | [627.74; 849.42] |
|
| Cp,gas | 373.79 | J/mol×K | 627.74 | Joback Calculated Property |
| Cp,gas | 386.00 | J/mol×K | 664.69 | Joback Calculated Property |
| Cp,gas | 397.47 | J/mol×K | 701.63 | Joback Calculated Property |
| Cp,gas | 408.20 | J/mol×K | 738.58 | Joback Calculated Property |
| Cp,gas | 418.20 | J/mol×K | 775.53 | Joback Calculated Property |
| Cp,gas | 427.46 | J/mol×K | 812.47 | Joback Calculated Property |
| Cp,gas | 435.99 | J/mol×K | 849.42 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to bis-(2-Oxobutyl) disulfide.
Sources
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