Basic information
- CAS
92671-71-1- Standard SMILES
CC(=O)CC(=O)N1CCCC(C)C1- InChIKey
IFEKQKFWZADYMY-UHFFFAOYSA-N- Molecular formula
- C10H17NO2
- Average molar mass
- 183.25 g/mol
- Monoisotopic mass
- 183.12592879
Names & identifiers
- Preferred name
- 1-(3-Methylpiperidin-1-yl)butane-1,3-dione
- IUPAC
- 1-(3-methylpiperidin-1-yl)butane-1,3-dione
- English name
- 1-(3-methylpiperidin-1-yl)butane-1,3-dione
- Molecular formula
- C10H17NO2
- Molecular weight
- 183.24748
Names & synonyms
1-(3-methylpiperidin-1-yl)butane-1,3-dione92671-71-1DTXSID90304589RefChem:224551DTXCID102557211-Acetoacetyl-3-MethylpiperidineNSC166410SCHEMBL13931196AKOS000165979AKOS016044742NSC-1664104-(3-methylpiperidin-1-yl)-4-oxobutan-2-one
Database identifiers
- CAS
92671-71-1- PubChem CID
- 296334
- DTXSID
DTXSID90304589
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 37.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 213
Chemistry & industry
Suppliers2 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
UKRORGSYN-BB[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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