- InChI
- InChI=1S/C11H23NS/c1-2-3-4-5-6-7-8-11-12-9-10-13-11/h11-12H,2-10H2,1H3
- InChI Key
- PBDQYMCEPIQARI-UHFFFAOYSA-N
- Formula
- C11H23NS
- SMILES
- CCCCCCCCC1NCCS1
- Molecular Weight1
- 201.37
- 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° | 205.86 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -126.82 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 31.43 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 52.91 | kJ/mol | Joback Calculated Property |
| log10WS | -4.00 | Crippen Calculated Property | |
| logPoct/wat | 3.399 | Crippen Calculated Property | |
| McVol | 181.320 | ml/mol | McGowan Calculated Property |
| Pc | 2322.54 | kPa | Joback Calculated Property |
| Inp | [1616.00; 1616.00] |
|
|
| Inp | 1616.00 | NIST | |
| Inp | 1616.00 | NIST | |
| Tboil | 562.74 | K | Joback Calculated Property |
| Tc | 767.42 | K | Joback Calculated Property |
| Tfus | 413.11 | K | Joback Calculated Property |
| Vc | 0.675 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [451.08; 550.18] | J/mol×K | [562.74; 767.42] |
|
| Cp,gas | 451.08 | J/mol×K | 562.74 | Joback Calculated Property |
| Cp,gas | 469.92 | J/mol×K | 596.85 | Joback Calculated Property |
| Cp,gas | 487.79 | J/mol×K | 630.97 | Joback Calculated Property |
| Cp,gas | 504.72 | J/mol×K | 665.08 | Joback Calculated Property |
| Cp,gas | 520.74 | J/mol×K | 699.20 | Joback Calculated Property |
| Cp,gas | 535.88 | J/mol×K | 733.31 | Joback Calculated Property |
| Cp,gas | 550.18 | J/mol×K | 767.42 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-octylthiazolidine.
Sources
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