- InChI
- InChI=1S/C6H10S/c1-3-5-7-6-4-2/h3-4,6H,1,5H2,2H3/b6-4+
- InChI Key
- GHMLMYZSPZIABJ-GQCTYLIASA-N
- Formula
- C6H10S
- SMILES
- C=CCSC=CC
- Molecular Weight1
- 114.21
- CAS
- 104324-36-9
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 200.82 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 117.35 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 14.35 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 35.06 | kJ/mol | Joback Calculated Property |
| log10WS | -2.42 | Crippen Calculated Property | |
| logPoct/wat | 2.439 | Crippen Calculated Property | |
| McVol | 103.150 | ml/mol | McGowan Calculated Property |
| Pc | 3530.46 | kPa | Joback Calculated Property |
| Inp | [890.90; 890.90] |
|
|
| Inp | 890.90 | NIST | |
| Inp | 890.90 | NIST | |
| Tboil | 406.30 | K | Joback Calculated Property |
| Tc | 609.54 | K | Joback Calculated Property |
| Tfus | 184.94 | K | Joback Calculated Property |
| Vc | 0.387 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [176.33; 231.13] | J/mol×K | [406.30; 609.54] |
|
| Cp,gas | 176.33 | J/mol×K | 406.30 | Joback Calculated Property |
| Cp,gas | 186.76 | J/mol×K | 440.17 | Joback Calculated Property |
| Cp,gas | 196.65 | J/mol×K | 474.05 | Joback Calculated Property |
| Cp,gas | 206.01 | J/mol×K | 507.92 | Joback Calculated Property |
| Cp,gas | 214.86 | J/mol×K | 541.79 | Joback Calculated Property |
| Cp,gas | 223.22 | J/mol×K | 575.66 | Joback Calculated Property |
| Cp,gas | 231.13 | J/mol×K | 609.54 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (E)-Allyl(prop-1-en-1-yl)sulfane.
Sources
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