- InChI
- InChI=1S/C3H7NO/c1-2-4-5-3-1/h4H,1-3H2
- InChI Key
- CIISBYKBBMFLEZ-UHFFFAOYSA-N
- Formula
- C3H7NO
- SMILES
- C1CNOC1
- Molecular Weight1
- 73.09
- CAS
- 504-72-3
- Other Names
-
- Isoxazole, tetrahydro-
- 1-Oxa-2-azacyclopentane
- 1,2-Oxazolidine
- 2-Isoxazolidine
- 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).
- 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° | 20.23 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -118.62 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 13.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 34.11 | kJ/mol | Joback Calculated Property |
| IE | 9.57 | eV | NIST |
| log10WS | -0.24 | Crippen Calculated Property | |
| logPoct/wat | -0.089 | Crippen Calculated Property | |
| McVol | 58.120 | ml/mol | McGowan Calculated Property |
| Pc | 6132.23 | kPa | Joback Calculated Property |
| Tboil | 363.49 | K | Joback Calculated Property |
| Tc | 574.99 | K | Joback Calculated Property |
| Tfus | 270.31 | K | Joback Calculated Property |
| Vc | 0.203 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [94.20; 143.30] | J/mol×K | [363.49; 574.99] | 
|
| Cp,gas | 94.20 | J/mol×K | 363.49 | Joback Calculated Property |
| Cp,gas | 103.50 | J/mol×K | 398.74 | Joback Calculated Property |
| Cp,gas | 112.34 | J/mol×K | 433.99 | Joback Calculated Property |
| Cp,gas | 120.72 | J/mol×K | 469.24 | Joback Calculated Property |
| Cp,gas | 128.67 | J/mol×K | 504.49 | Joback Calculated Property |
| Cp,gas | 136.19 | J/mol×K | 539.74 | Joback Calculated Property |
| Cp,gas | 143.30 | J/mol×K | 574.99 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isoxazolidine.
Sources
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