3-methyl-4-oxopentanoic acid
Catalog No: FT-0692224
CAS No: 6628-79-1
- Chemical Name: 3-methyl-4-oxopentanoic acid
- Molecular Formula: C6H10O3
- Molecular Weight: 130.14
- InChI Key: NFIWUVRBASXMGK-UHFFFAOYSA-N
- InChI: InChI=1S/C6H10O3/c1-4(5(2)7)3-6(8)9/h4H,3H2,1-2H3,(H,8,9)
| 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 |
| Product_Name: | β-Methyllevulinic Acid |
|---|---|
| Flash_Point: | 116.5ºC |
| Melting_Point: | 32ºC |
| FW: | 130.14200 |
| Density: | 1.087g/cm3 |
| CAS: | 6628-79-1 |
| Bolling_Point: | 242ºC |
| MF: | C6H10O3 |
| Density: | 1.087g/cm3 |
|---|---|
| Computational_Chemistry: | ['1. XlogP :0 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :3 ', '6. TPSA 544 ', '7. Heavy Atom Count :9 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :128 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :1 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1'] |
| LogP: | 0.68620 |
| Flash_Point: | 116.5ºC |
| Melting_Point: | 32ºC |
| FW: | 130.14200 |
| PSA: | 54.37000 |
| Exact_Mass: | 130.06300 |
| MF: | C6H10O3 |
| Bolling_Point: | 242ºC |
| Refractive_Index: | 1.437 |
| Risk_Statements(EU): | 36/37/38 |
|---|---|
| HS_Code: | 2918300090 |
| Safety_Statements: | 26-36/37/39 |
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