- InChI
- InChI=1S/C10H21NS/c1-2-3-4-5-6-7-10-11-8-9-12-10/h10-11H,2-9H2,1H3
- InChI Key
- FLUFGKPXTPJANY-UHFFFAOYSA-N
- Formula
- C10H21NS
- SMILES
- CCCCCCCC1NCCS1
- Molecular Weight1
- 187.34
- CAS
- 706-19-4
- Other Names
-
- Thiazolidine, 2-heptyl-
- 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).
- Inp : Non-polar retention indices.
- I : 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 |
|---|---|---|---|
| ω | 0.4979 | Relay (1.0) Calculated Property | |
| ΔfG° | 197.44 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -128.97 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 28.84 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.52 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.57 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.94 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.009 | Crippen Calculated Property | |
| McVol | 167.230 | ml/mol | McGowan Calculated Property |
| Pc | 2553.34 | kPa | Joback Calculated Property |
| Inp | 1509.00 | NIST | |
| I | 2083.00 | NIST | |
| Tboil | 540.24 | K | Relay (1.0) Calculated Property |
| Tc | 738.33 | K | Relay (1.0) Calculated Property |
| Tfus | 299.55 | K | Relay (1.0) Calculated Property |
| Vc | 0.612 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [401.48; 497.34] | J/mol×K | [539.86; 747.72] | 
|
| Cp,gas | 401.48 | J/mol×K | 539.86 | Joback Calculated Property |
| Cp,gas | 419.72 | J/mol×K | 574.50 | Joback Calculated Property |
| Cp,gas | 437.01 | J/mol×K | 609.15 | Joback Calculated Property |
| Cp,gas | 453.39 | J/mol×K | 643.79 | Joback Calculated Property |
| Cp,gas | 468.88 | J/mol×K | 678.44 | Joback Calculated Property |
| Cp,gas | 483.52 | J/mol×K | 713.08 | Joback Calculated Property |
| Cp,gas | 497.34 | J/mol×K | 747.72 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-heptylthiazolidine.
Sources
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