![7-Thiabicyclo[4.1.0]heptane](/cid/65-930-7/7-Thiabicyclo-4-1-0-heptane.png "7-Thiabicyclo[4.1.0]heptane")
- InChI
- InChI=1S/C6H10S/c1-2-4-6-5(3-1)7-6/h5-6H,1-4H2
- InChI Key
- PQWJNIJNYRPOAA-UHFFFAOYSA-N
- Formula
- C6H10S
- SMILES
- C1CCC2SC2C1
- Molecular Weight1
- 114.21
- CAS
- 286-28-2
- Other Names
-
- Cyclohexane, 1,2-epithio-
- Cyclohexene episulfide
- Cyclohexene sulfide
- 1,2-Cyclohexylene sulfide
- 1,2-epithiocyclohexane
- 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).
- I : Polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (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 | 0.2443 | Relay (... Calculated Property | |
| ΔfG° | 148.90 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 40.27 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 9.12 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 40.65 | kJ/mol | Relay (... Calculated Property |
| IE | 8.37 | eV | Relay (... Calculated Property |
| log10WS | -2.80 | Relay (... Calculated Property | |
| logPoct/wat | 2.044 | Crippen Calculated Property | |
| McVol | 90.030 | ml/mol | McGowan Calculated Property |
| Pc | 4356.87 | kPa | Joback Calculated Property |
| I | 1390.00 | NIST | |
| Tboil | 443.26 | K | Relay (... Calculated Property |
| Tc | 676.92 | K | Relay (... Calculated Property |
| Tfus | 312.23 | K | Relay (... Calculated Property |
| Vc | 0.315 | m3/kmol | Relay (... 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 |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 329.70 | K | 1.60 | NIST |
Similar Compounds
![7-Thiabicyclo[2.2.1]heptane.](data:image/png;base64,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)
Find more compounds similar to 7-Thiabicyclo[4.1.0]heptane.
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