methyl isobutyl ketone
(NTIZESTWPVYFNL-UHFFFAOYSA-N)
Structure
- SMILES
- CC(CC(=O)C)C
- Molecular Formula:
- C6H12O
- Molecular Weight:
- 100.159
- Log P:
- 1.6215
- Hydrogen Bond Acceptor:
- 1
- Hydrogen Bond Donor:
- 0
- TPSA:
- 17.07
- CAS Number(s):
- 108-10-1
Synonym(s)
1.
methyl isobutyl ketone
2.
4-methyl-2-pentanone
3.
isobutyl methyl ketone
4.
isopropylacetone
External Link(s)
| MeSH | C005458 |
| PubChem Compound | 7909 |
| ChEBI | 82344 |
| CHEMBL | CHEMBL285323 |
| KEGG | cpd:C19263 dr:D04989 |
| ZINC | 1482107 |
Adverse Drug Event(s)
| Name | Number of Reports | Reference(s) | Data Source | |
|---|---|---|---|---|
| 1 | Chemical and Drug Induced Liver Injury | 3388417 | CTD | |
| 2 | Kidney Diseases | 25797582 | CTD |
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