- InChI
- InChI=1S/C6H11NO2/c1-5-7-6(2,3-8)4-9-5/h8H,3-4H2,1-2H3
- InChI Key
- YWLSGHOSSUXBJK-UHFFFAOYSA-N
- Formula
- C6H11NO2
- SMILES
- CC1=NC(C)(CO)CO1
- Molecular Weight1
- 129.16
- CAS
- 39986-37-3
- Other Names
-
- 2,4-Dimethyl-4-hydroxymethyl-2-oxazoline
- 4-Oxazolemethanol, 4,5-dihydro-2,4-dimethyl-
- 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).
- 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 |
|---|---|---|---|
| ω | 0.5524 | Relay (... Calculated Property | |
| ΔfG° | -55.13 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -354.54 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 16.97 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.31 | kJ/mol | Relay (... Calculated Property |
| IE | 8.98 | eV | Relay (... Calculated Property |
| log10WS | 0.08 | Relay (... Calculated Property | |
| logPoct/wat | 0.186 | Crippen Calculated Property | |
| McVol | 101.960 | ml/mol | McGowan Calculated Property |
| Pc | 4665.71 | kPa | Joback Calculated Property |
| Tboil | 474.99 | K | Relay (... Calculated Property |
| Tc | 714.86 | K | Relay (... Calculated Property |
| Tfus | 313.02 | K | Relay (... Calculated Property |
| Vc | 0.373 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [255.61; 315.42] | J/mol×K | [529.17; 737.11] | 
|
| Cp,gas | 255.61 | J/mol×K | 529.17 | Joback Calculated Property |
| Cp,gas | 267.04 | J/mol×K | 563.83 | Joback Calculated Property |
| Cp,gas | 277.79 | J/mol×K | 598.48 | Joback Calculated Property |
| Cp,gas | 287.92 | J/mol×K | 633.14 | Joback Calculated Property |
| Cp,gas | 297.51 | J/mol×K | 667.80 | Joback Calculated Property |
| Cp,gas | 306.66 | J/mol×K | 702.46 | Joback Calculated Property |
| Cp,gas | 315.42 | J/mol×K | 737.11 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 378.00 ± 1.00 | K | 2.00 | NIST |
Similar Compounds
Find more compounds similar to 2,4-Dimethyl-2-oxazoline-4-methanol.
Sources
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