Basic information
- Standard SMILES
O=C1CC(=O)C2(CCCCC2)O1- InChIKey
RAZCWQWIJJKSCC-UHFFFAOYSA-N- Molecular formula
- C9H12O3
- Average molar mass
- 168.19 g/mol
- Monoisotopic mass
- 168.07864424
Names & identifiers
- Preferred name
- 1-Oxaspiro(4.5)decane-2,4-dione
- IUPAC
- 1-oxaspiro[4.5]decane-2,4-dione
- English name
- 1-Oxaspiro[4.5]decane-2,4-dione
- Molecular formula
- C9H12O3
- Molecular weight
- 168.19
Names & synonyms
1-Oxaspiro[4.5]decane-2,4-dione22884-78-2DTXSID403407101-Oxaspiro(4.5)decane-2,4-dioneRefChem:232793DTXCID20291791RAZCWQWIJJKSCC-UHFFFAOYSA-NSCHEMBL5571095
Database identifiers
- CAS
22884-78-2- PubChem CID
- 566677
- DTXSID
DTXSID40340710- Nikkaji
- J100.334H
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 226
Chemistry & industry
Suppliers4 total
上海拓目化工有限公司13391076197 · [email protected]
上海普黎康化工科技有限公司021-54321516 17717324060 · [email protected]
济南光尘医药科技有限公司18563726319 · [email protected]
武汉万鉴生物科技有限公司13277087647 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Linked notes
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