Ethyl 2-isopropylacetoacetate
- Product NameEthyl 2-isopropylacetoacetate
- CAS1522-46-9
- MFC9H16O3
- MW172.22
- EINECS216-192-6
- MOL File1522-46-9.mol
Chemical Properties
| Boiling point | 82-85 °C/12 mmHg (lit.) |
| Density | 0.962 g/mL at 20 °C (lit.) |
| refractive index | n |
| Flash point | 76 °C |
| storage temp. | 2-8°C |
| solubility | Chloroform, Ethyl Acetate |
| form | Oil |
| pka | 12.28±0.46(Predicted) |
| color | Clear Colorless |
| BRN | 636360 |
| InChI | InChI=1S/C9H16O3/c1-5-12-9(11)8(6(2)3)7(4)10/h6,8H,5H2,1-4H3 |
| InChIKey | DMIFFKCVURTPTG-UHFFFAOYSA-N |
| SMILES | C(OCC)(=O)C(C(C)=O)C(C)C |
| LogP | 1.584 (est) |
| CAS DataBase Reference | 1522-46-9(CAS DataBase Reference) |
| NIST Chemistry Reference | Butanoic acid, 2-acetyl-3-methyl-, ethyl ester(1522-46-9) |
| EPA Substance Registry System | Ethyl 2-isopropylacetoacetate (1522-46-9) |
Safety Information
| Safety Statements | 23-24/25 |
| WGK Germany | 3 |
| TSCA | TSCA listed |
| HS Code | 2918300090 |
| Storage Class | 10 - Combustible liquids |