- InChI
- InChI=1S/C4H7NO2/c1-3-2-7-4(6)5-3/h3H,2H2,1H3,(H,5,6)
- InChI Key
- VAJFEOKPKHIPEN-UHFFFAOYSA-N
- Formula
- C4H7NO2
- SMILES
- CC1COC(=O)N1
- Molecular Weight1
- 101.10
- CAS
- 16112-59-7
- 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° | -101.65 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -297.30 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.13 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 40.27 | kJ/mol | Joback Calculated Property |
| IE | 9.95 | eV | NIST |
| log10WS | -0.53 | Crippen Calculated Property | |
| logPoct/wat | 0.115 | Crippen Calculated Property | |
| McVol | 73.780 | ml/mol | McGowan Calculated Property |
| Pc | 5320.16 | kPa | Joback Calculated Property |
| Tboil | 449.52 | K | Joback Calculated Property |
| Tc | 680.29 | K | Joback Calculated Property |
| Tfus | 345.56 | K | Joback Calculated Property |
| Vc | 0.266 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [150.46; 208.47] | J/mol×K | [449.52; 680.29] | 
|
| Cp,gas | 150.46 | J/mol×K | 449.52 | Joback Calculated Property |
| Cp,gas | 161.09 | J/mol×K | 487.98 | Joback Calculated Property |
| Cp,gas | 171.37 | J/mol×K | 526.44 | Joback Calculated Property |
| Cp,gas | 181.27 | J/mol×K | 564.90 | Joback Calculated Property |
| Cp,gas | 190.78 | J/mol×K | 603.36 | Joback Calculated Property |
| Cp,gas | 199.85 | J/mol×K | 641.82 | Joback Calculated Property |
| Cp,gas | 208.47 | J/mol×K | 680.29 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Oxazolidinone,4-methyl-.
Sources
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