- InChI
- InChI=1S/C6H11NO3/c1-5-7-6(2-8,3-9)4-10-5/h8-9H,2-4H2,1H3
- InChI Key
- RUILRLCHVAUQDK-UHFFFAOYSA-N
- Formula
- C6H11NO3
- SMILES
- CC1=NC(CO)(CO)CO1
- Molecular Weight1
- 145.16
- CAS
- 4271-18-5
- 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).
- 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° | -191.95 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -410.63 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 21.06 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.09 | kJ/mol | Joback Calculated Property |
| log10WS | 0.39 | Crippen Calculated Property | |
| logPoct/wat | -0.842 | Crippen Calculated Property | |
| McVol | 107.830 | ml/mol | McGowan Calculated Property |
| Pc | 5312.41 | kPa | Joback Calculated Property |
| Tboil | 621.35 | K | Joback Calculated Property |
| Tc | 816.17 | K | Joback Calculated Property |
| Tfus | 425.21 | K | Joback Calculated Property |
| Vc | 0.405 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [301.55; 352.55] | J/mol×K | [621.35; 816.17] | 
|
| Cp,gas | 301.55 | J/mol×K | 621.35 | Joback Calculated Property |
| Cp,gas | 310.95 | J/mol×K | 653.82 | Joback Calculated Property |
| Cp,gas | 319.90 | J/mol×K | 686.29 | Joback Calculated Property |
| Cp,gas | 328.47 | J/mol×K | 718.76 | Joback Calculated Property |
| Cp,gas | 336.72 | J/mol×K | 751.23 | Joback Calculated Property |
| Cp,gas | 344.73 | J/mol×K | 783.70 | Joback Calculated Property |
| Cp,gas | 352.55 | J/mol×K | 816.17 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Methyl-4,4-dimethylol oxazoline.
Sources
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