methyl 3-hydroxybutyrate
- Product Namemethyl 3-hydroxybutyrate
- CAS1487-49-6
- CBNumberCB0927622
- MFC5H10O3
- MW118.13
- EINECS216-068-1
- MDL NumberMFCD00129999
- MOL File1487-49-6.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 173-177 °C |
| Boiling point | 160.67°C (rough estimate) |
| Density | 1.0889 (rough estimate) |
| refractive index | 1.4056 (estimate) |
| FEMA | 4450 | METHYL 3-HYDROXYBUTYRATE |
| solubility | Chloroform (Slightly), Methanol (Slightly) |
| form | Oil |
| pka | 13.95±0.20(Predicted) |
| color | Colourless |
| Odor | at 100.00 %. mild fruity green apple winey |
| Odor Type | apple |
| biological source | synthetic |
| JECFA Number | 1947 |
| Major Application | flavors and fragrances |
| InChI | InChI=1S/C5H10O3/c1-4(6)3-5(7)8-2/h4,6H,3H2,1-2H3 |
| InChIKey | LDLDJEAVRNAEBW-UHFFFAOYSA-N |
| SMILES | C(OC)(=O)CC(O)C |
| LogP | -0.55 |
Safety
| Symbol(GHS) |
|
| Signal word | Warning |
| Hazard statements | H315-H319-H335 |
| Precautionary statements | P261-P264-P271-P280-P302+P352-P305+P351+P338 |
| WGK Germany | WGK 3 |
| RTECS | ET4700000 |
| Storage Class | 10 - Combustible liquids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
