- InChI
- InChI=1S/C3H7NS/c1-2-5-3-4-1/h4H,1-3H2
- InChI Key
- OGYGFUAIIOPWQD-UHFFFAOYSA-N
- Formula
- C3H7NS
- SMILES
- C1CSCN1
- Molecular Weight1
- 89.16
- CAS
- 504-78-9
- Other Names
-
- Thiazolidine
- Tetrahydrothiazole
- 1-Thia-3-azacyclopentane
- 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.
- 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 |
|---|---|---|---|
| ΔfG° | 146.21 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 58.64 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 9.64 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 35.41 | kJ/mol | Joback Calculated Property |
| log10WS | -0.54 | Crippen Calculated Property | |
| logPoct/wat | 0.280 | Crippen Calculated Property | |
| McVol | 68.600 | ml/mol | McGowan Calculated Property |
| Pc | 6161.14 | kPa | Joback Calculated Property |
| Inp | [902.00; 909.00] |
|
|
| Inp | 903.00 | NIST | |
| Inp | 909.00 | NIST | |
| Inp | 902.00 | NIST | |
| Inp | 903.00 | NIST | |
| Inp | 902.00 | NIST | |
| I | [1460.00; 1460.00] |
|
|
| I | 1460.00 | NIST | |
| I | 1460.00 | NIST | |
| Tboil | 437.70 | K | NIST |
| Tc | 614.68 | K | Joback Calculated Property |
| Tfus | 327.19 | K | Joback Calculated Property |
| Vc | 0.229 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [107.14; 157.77] | J/mol×K | [384.37; 614.68] |
|
| Cp,gas | 107.14 | J/mol×K | 384.37 | Joback Calculated Property |
| Cp,gas | 116.93 | J/mol×K | 422.76 | Joback Calculated Property |
| Cp,gas | 126.15 | J/mol×K | 461.14 | Joback Calculated Property |
| Cp,gas | 134.82 | J/mol×K | 499.53 | Joback Calculated Property |
| Cp,gas | 142.96 | J/mol×K | 537.91 | Joback Calculated Property |
| Cp,gas | 150.61 | J/mol×K | 576.30 | Joback Calculated Property |
| Cp,gas | 157.77 | J/mol×K | 614.68 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 346.70 | K | 3.30 | NIST |
Similar Compounds
Find more compounds similar to Thiazole, tetrahydro-.
Sources
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