5-Methyl-4-isoxazolecarboxylic acid
Catalog No: FT-0620664
CAS No: 42831-50-5
- Chemical Name: 5-Methyl-4-isoxazolecarboxylic acid
- Molecular Formula: C5H4NO3-
- Molecular Weight: 126.09
- InChI Key: VQBXUKGMJCPBMF-UHFFFAOYSA-M
- InChI: InChI=1S/C5H5NO3/c1-3-4(5(7)8)2-6-9-3/h2H,1H3,(H,7,8)/p-1
| Assay | Pack Size | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| Melting_Point: | 144-148 °C(lit.) |
|---|---|
| CAS: | 42831-50-5 |
| MF: | C5H5NO3 |
| Flash_Point: | 140.3±22.3 °C |
| Product_Name: | 5-Methyl-4-isoxazolecarboxylic acid |
| Density: | 1.3±0.1 g/cm3 |
| FW: | 127.098 |
| Bolling_Point: | 308.3±22.0 °C at 760 mmHg |
| Refractive_Index: | 1.514 |
|---|---|
| Vapor_Pressure: | 0.0±0.7 mmHg at 25°C |
| Flash_Point: | 140.3±22.3 °C |
| LogP: | 0.22 |
| Bolling_Point: | 308.3±22.0 °C at 760 mmHg |
| FW: | 127.098 |
| PSA: | 63.33000 |
| Computational_Chemistry: | ['1. XlogP :03 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 633 ', '7. Heavy Atom Count :9 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :125 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1'] |
| Melting_Point: | 144-148 °C(lit.) |
| MF: | C5H5NO3 |
| Exact_Mass: | 127.026939 |
| Density: | 1.3±0.1 g/cm3 |
| More_Info: | ['1 . Appearance 晶体 ', '2 . Density(g/mL,25ºC)Unknow ', '3 . Relative vapor density(g/mL,Atmosphere =1) Unknow ', '4 . Melting point(ºC)144-149 ', '5 . Boiling point(ºC)Unknow ', '6 . Boiling point(ºC,17mm hg)Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point(ºC)Unknow ', '9 . Specific rotation(ºC)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC) Unknow ', '11 . Vapor pressure(kPa,20ºC)Unknow ', '12 . Saturated vapor pressure(kPa,60ºC)Unknow ', '13 . Combustion heat(KJ/mol)Unknow ', '14 . Critical temperature(ºC)Unknow ', '15 . Critical pressure(KPa)Unknow ', '16 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion(%,V/V)Unknow ', '18 . Lower limit of explosion(%,V/V)Unknow ', '19 . Solubility Unknow'] |
| Safety_Statements: | S22-S26-S36/37/39-S36 |
|---|---|
| Hazard_Codes: | Xi:Irritant; |
| HS_Code: | 2934999090 |
| Risk_Statements(EU): | R36/37/38 |
| WGK_Germany: | 3 |
Related Products
3,4-Pyrrolidinediol, 2-[(4-methoxyphenyl)methyl]-, 3-acetate, (2S,3R,4R)-
(4S)-2-[[[(2R)-2-AMino-2-(4-hydroxyphenyl)acetyl]aMino]Methyl]-5,5-diMethyl-4-thiazolidinecarboxylic Acid (Mixture of DiastereoMers)