![7-Thiabicyclo[2.2.1]heptane](/cid/77-813-4/7-Thiabicyclo-2-2-1-heptane.png "7-Thiabicyclo[2.2.1]heptane")
- InChI
- InChI=1S/C6H10S/c1-2-6-4-3-5(1)7-6/h5-6H,1-4H2
- InChI Key
- YADULIHSBVCGOJ-UHFFFAOYSA-N
- Formula
- C6H10S
- SMILES
- C1CC2CCC1S2
- Molecular Weight1
- 114.21
- CAS
- 279-59-4
- Other Names
-
- 7-Thianorboranane
- 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).
- 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° | 148.90 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 17.53 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 9.12 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 34.76 | kJ/mol | Joback Calculated Property |
| log10WS | -2.23 | Crippen Calculated Property | |
| logPoct/wat | 2.044 | Crippen Calculated Property | |
| McVol | 90.030 | ml/mol | McGowan Calculated Property |
| Pc | 4356.87 | kPa | Joback Calculated Property |
| Tboil | 402.26 | K | Joback Calculated Property |
| Tc | 625.03 | K | Joback Calculated Property |
| Tfus | 273.19 | K | Joback Calculated Property |
| Vc | 0.324 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [167.53; 242.53] | J/mol×K | [402.26; 625.03] | 
|
| Cp,gas | 167.53 | J/mol×K | 402.26 | Joback Calculated Property |
| Cp,gas | 182.56 | J/mol×K | 439.39 | Joback Calculated Property |
| Cp,gas | 196.48 | J/mol×K | 476.52 | Joback Calculated Property |
| Cp,gas | 209.36 | J/mol×K | 513.65 | Joback Calculated Property |
| Cp,gas | 221.28 | J/mol×K | 550.77 | Joback Calculated Property |
| Cp,gas | 232.32 | J/mol×K | 587.90 | Joback Calculated Property |
| Cp,gas | 242.53 | J/mol×K | 625.03 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 7-Thiabicyclo[2.2.1]heptane.
Sources
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