- InChI
- InChI=1S/C10H22S/c1-7(2)9(5)11-10(6)8(3)4/h7-10H,1-6H3
- InChI Key
- WGOMZHJEFQQPAK-UHFFFAOYSA-N
- Formula
- C10H22S
- SMILES
- CC(C)C(C)SC(C)C(C)C
- Molecular Weight1
- 174.35
- 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 | 0.3636 | Relay (... Calculated Property | |
| ΔfG° | 56.68 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -238.58 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 11.69 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 51.17 | kJ/mol | Relay (... Calculated Property |
| IE | 8.02 | eV | Relay (... Calculated Property |
| log10WS | -4.23 | Relay (... Calculated Property | |
| logPoct/wat | 3.809 | Crippen Calculated Property | |
| McVol | 168.110 | ml/mol | McGowan Calculated Property |
| Pc | 2206.22 | kPa | Joback Calculated Property |
| Inp | [1123.00; 1123.00] |
|
|
| Inp | 1123.00 | NIST | |
| Inp | 1123.00 | NIST | |
| Inp | 1123.00 | NIST | |
| Tboil | 471.85 | K | Relay (... Calculated Property |
| Tc | 649.24 | K | Relay (... Calculated Property |
| Tfus | 223.71 | K | Relay (... Calculated Property |
| Vc | 0.590 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [376.62; 469.74] | J/mol×K | [495.22; 693.44] |
|
| Cp,gas | 376.62 | J/mol×K | 495.22 | Joback Calculated Property |
| Cp,gas | 394.10 | J/mol×K | 528.26 | Joback Calculated Property |
| Cp,gas | 410.77 | J/mol×K | 561.29 | Joback Calculated Property |
| Cp,gas | 426.65 | J/mol×K | 594.33 | Joback Calculated Property |
| Cp,gas | 441.76 | J/mol×K | 627.37 | Joback Calculated Property |
| Cp,gas | 456.12 | J/mol×K | 660.40 | Joback Calculated Property |
| Cp,gas | 469.74 | J/mol×K | 693.44 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,3,5,6-tetramethyl-4-thiaheptane.
Sources
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