- InChI
- InChI=1S/C10H20S/c1-9(2)5-6-10(3,4)8-11-7-9/h5-8H2,1-4H3
- InChI Key
- KYRUZIUZBMLVTF-UHFFFAOYSA-N
- Formula
- C10H20S
- SMILES
- CC1(C)CCC(C)(C)CSC1
- Molecular Weight1
- 172.33
- CAS
- 53561-47-0
- 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).
- 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° | 66.84 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -146.17 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 3.52 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 41.66 | kJ/mol | Joback Calculated Property |
| IE | 8.15 | eV | NIST |
| log10WS | -3.30 | Crippen Calculated Property | |
| logPoct/wat | 3.566 | Crippen Calculated Property | |
| McVol | 157.250 | ml/mol | McGowan Calculated Property |
| Pc | 2778.85 | kPa | Joback Calculated Property |
| Tboil | 495.66 | K | Joback Calculated Property |
| Tc | 733.68 | K | Joback Calculated Property |
| Tfus | 333.33 | K | Joback Calculated Property |
| Vc | 0.561 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [354.67; 462.69] | J/mol×K | [495.66; 733.68] | 
|
| Cp,gas | 354.67 | J/mol×K | 495.66 | Joback Calculated Property |
| Cp,gas | 375.91 | J/mol×K | 535.33 | Joback Calculated Property |
| Cp,gas | 395.52 | J/mol×K | 575.00 | Joback Calculated Property |
| Cp,gas | 413.76 | J/mol×K | 614.67 | Joback Calculated Property |
| Cp,gas | 430.87 | J/mol×K | 654.34 | Joback Calculated Property |
| Cp,gas | 447.09 | J/mol×K | 694.01 | Joback Calculated Property |
| Cp,gas | 462.69 | J/mol×K | 733.68 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Thiacycloheptane,3,3,6,6-tetramethyl-.
Sources
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