1-Adamantyl methyl ketone
- CAS NO.：1660-04-4
- Empirical Formula: C12H18O
- Molecular Weight: 178.27
- MDL number: MFCD00074739
- EINECS: 216-761-9
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-04-10 11:19:08
What is 1-Adamantyl methyl ketone?
Chemical properties
WHITE CRYSTALLINE POWDER
The Uses of 1-Adamantyl methyl ketone
1-Adamantyl methyl ketone, is used as an important raw material and intermediate used in organic Synthesis, pharmaceuticals, agrochemicals and dyestuff.
General Description
1-Adamantyl methyl ketone, a sterically bulky ketone substrate, was reduced to the corresponding alcohol with excellent optical purity.
Properties of 1-Adamantyl methyl ketone
| Melting point: | 53-55 °C (lit.) |
| Boiling point: | 250.52°C (rough estimate) |
| Density | 0.9172 (rough estimate) |
| refractive index | 1.5050 (estimate) |
| Flash point: | 227 °F |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | Chloroform (Slightly), Methanol (Slightly) |
| form | Crystalline Powder |
| color | White |
| Water Solubility | Soluble in methanol- very faint turbidity. Insoluble in water. |
| InChI | InChI=1S/C12H18O/c1-8(13)12-5-9-2-10(6-12)4-11(3-9)7-12/h9-11H,2-7H2,1H3 |
| CAS DataBase Reference | 1660-04-4(CAS DataBase Reference) |
| NIST Chemistry Reference | 1-Adamantyl methyl ketone(1660-04-4) |
Safety information for 1-Adamantyl methyl ketone
| Signal word | Warning |
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H302:Acute toxicity,oral H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
| Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
Computed Descriptors for 1-Adamantyl methyl ketone
| InChIKey | DACIGVIOAFXPHW-UHFFFAOYSA-N |
| SMILES | C(=O)(C12CC3CC(CC(C3)C1)C2)C |
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