![bis-[3,3-(2-Methylpropanol-1)] disulfide](/cid/20-415-8/bis-3-3-2-Methylpropanol-1-disulfide.png "bis-[3,3-(2-Methylpropanol-1)] disulfide")
- InChI
- InChI=1S/C8H18O2S2/c1-7(3-9)5-11-12-6-8(2)4-10/h7-10H,3-6H2,1-2H3
- InChI Key
- CIGKJLHBHYZCPS-UHFFFAOYSA-N
- Formula
- C8H18O2S2
- SMILES
- CC(CO)CSSCC(C)CO
- Molecular Weight1
- 210.36
- 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° | -195.80 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -439.73 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 25.87 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.62 | kJ/mol | Joback Calculated Property |
| log10WS | -1.97 | Crippen Calculated Property | |
| logPoct/wat | 1.625 | Crippen Calculated Property | |
| McVol | 168.020 | ml/mol | McGowan Calculated Property |
| Pc | 3257.86 | kPa | Joback Calculated Property |
| Inp | [1660.00; 1660.00] |
|
|
| Inp | 1660.00 | NIST | |
| Inp | 1660.00 | NIST | |
| Tboil | 703.48 | K | Joback Calculated Property |
| Tc | 894.37 | K | Joback Calculated Property |
| Tfus | 340.36 | K | Joback Calculated Property |
| Vc | 0.618 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [447.06; 501.92] | J/mol×K | [703.48; 894.37] |
|
| Cp,gas | 447.06 | J/mol×K | 703.48 | Joback Calculated Property |
| Cp,gas | 457.66 | J/mol×K | 735.29 | Joback Calculated Property |
| Cp,gas | 467.66 | J/mol×K | 767.11 | Joback Calculated Property |
| Cp,gas | 477.08 | J/mol×K | 798.92 | Joback Calculated Property |
| Cp,gas | 485.92 | J/mol×K | 830.74 | Joback Calculated Property |
| Cp,gas | 494.20 | J/mol×K | 862.55 | Joback Calculated Property |
| Cp,gas | 501.92 | J/mol×K | 894.37 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to bis-[3,3-(2-Methylpropanol-1)] disulfide.
Sources
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