- InChI
- InChI=1S/C10H22S2/c1-3-5-7-8-10-12-11-9-6-4-2/h3-10H2,1-2H3
- InChI Key
- AQCMTUGVHLFFKR-UHFFFAOYSA-N
- Formula
- C10H22S2
- SMILES
- CCCCCCSSCCCC
- Molecular Weight1
- 206.41
- CAS
- 64580-57-0
- Other Names
-
- Butyl hexyl disulfide
- 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).
- 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° | 99.56 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -165.99 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 29.92 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 51.49 | kJ/mol | Joback Calculated Property |
| log10WS | -4.77 | Crippen Calculated Property | |
| logPoct/wat | 4.748 | Crippen Calculated Property | |
| McVol | 184.460 | ml/mol | McGowan Calculated Property |
| Pc | 2175.46 | kPa | Joback Calculated Property |
| I | 1746.00 | NIST | |
| Tboil | 565.76 | K | Joback Calculated Property |
| Tc | 765.78 | K | Joback Calculated Property |
| Tfus | 271.26 | K | Joback Calculated Property |
| Vc | 0.704 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [435.05; 520.55] | J/mol×K | [565.76; 765.78] | 
|
| Cp,gas | 435.05 | J/mol×K | 565.76 | Joback Calculated Property |
| Cp,gas | 451.18 | J/mol×K | 599.10 | Joback Calculated Property |
| Cp,gas | 466.54 | J/mol×K | 632.43 | Joback Calculated Property |
| Cp,gas | 481.15 | J/mol×K | 665.77 | Joback Calculated Property |
| Cp,gas | 495.01 | J/mol×K | 699.11 | Joback Calculated Property |
| Cp,gas | 508.14 | J/mol×K | 732.45 | Joback Calculated Property |
| Cp,gas | 520.55 | J/mol×K | 765.78 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to n-Butyl n-hexyl disulfide.
Sources
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