356786-94-2
| Name | N-[(2R)-2,4-Dihydroxy-3,3-diMethyl-1-oxobutyl]- |
| CAS | 356786-94-2 |
| Molecular Formula | C9H16CaNO5+ |
| MDL Number | MFCD11656126 |
| Molecular Weight | 258.305 |
| MOL File | 356786-94-2.mol |
Chemical Properties
| Melting point | 175-183°C |
| storage temp. | Hygroscopic, -20°C Freezer, Under inert atmosphere |
| solubility | Methanol (Slightly, Sonicated, Heated), Water (Slightly) |
| form | Solid |
| color | Off-White to Pale Beige |
| Stability: | Hygroscopic |
| Major Application | clinical testing |
| InChI | InChI=1/C9H17NO5.Ca/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13;/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13);/q;+2/p-1/t7-;/s3 |
| InChIKey | SXRRAEDIIGNDNU-WMASNCOMNA-M |
| SMILES | C(O)C(C)(C)[C@H](O)C(=O)NCCC(=O)[O-].[Ca+2] |&1:5,r| |
Safety Data
| Symbol(GHS) |  GHS07 |
| Signal word | Warning |
| Hazard statements | H315-H319-H335 |
| Precautionary statements | P280-P302+P352-P362+P364 |
| WGK Germany | WGK 3 |
| HS Code | 2845909090 |
| Storage Class | 3 - Flammable liquids |
| Hazard Classifications | Acute Tox. 3 Dermal Acute Tox. 3 Inhalation Acute Tox. 3 Oral Flam. Liq. 2 STOT SE 1 |