- InChI
- InChI=1S/C11H21NS/c1-2-3-4-5-6-7-8-11-12-9-10-13-11/h6-7,11-12H,2-5,8-10H2,1H3/b7-6-
- InChI Key
- TWIKNBZHELKJGO-SREVYHEPSA-N
- Formula
- C11H21NS
- SMILES
- CCCCCC=CCC1NCCS1
- Molecular Weight1
- 199.36
- 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° | 286.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -9.60 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 31.63 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 52.86 | kJ/mol | Joback Calculated Property |
| log10WS | -3.86 | Crippen Calculated Property | |
| logPoct/wat | 3.176 | Crippen Calculated Property | |
| McVol | 177.020 | ml/mol | McGowan Calculated Property |
| Pc | 2443.48 | kPa | Joback Calculated Property |
| Inp | [1589.00; 1589.00] |
|
|
| Inp | 1589.00 | NIST | |
| Inp | 1589.00 | NIST | |
| Tboil | 566.90 | K | Joback Calculated Property |
| Tc | 780.63 | K | Joback Calculated Property |
| Tfus | 408.03 | K | Joback Calculated Property |
| Vc | 0.655 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [432.29; 528.41] | J/mol×K | [566.90; 780.63] |
|
| Cp,gas | 432.29 | J/mol×K | 566.90 | Joback Calculated Property |
| Cp,gas | 450.77 | J/mol×K | 602.52 | Joback Calculated Property |
| Cp,gas | 468.20 | J/mol×K | 638.14 | Joback Calculated Property |
| Cp,gas | 484.63 | J/mol×K | 673.77 | Joback Calculated Property |
| Cp,gas | 500.11 | J/mol×K | 709.39 | Joback Calculated Property |
| Cp,gas | 514.69 | J/mol×K | 745.01 | Joback Calculated Property |
| Cp,gas | 528.41 | J/mol×K | 780.63 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-((Z)-2-octenyl)thiazolidine.
Sources
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