2-Oxaspiro(4,5)decan-1-one
Basic information
- CAS
4420-11-5- Standard SMILES
O=C1OCCC12CCCCC2- InChIKey
VZHLSIACSZGPGA-UHFFFAOYSA-N- Molecular formula
- C9H14O2
- Average molar mass
- 154.21 g/mol
- Monoisotopic mass
- 154.09937969
Names & identifiers
- Preferred name
- 2-Oxaspiro(4,5)decan-1-one
- IUPAC
- 2-oxaspiro[4.5]decan-1-one
Names & synonyms
4420-11-52-OXASPIRO(4,5)DECAN-1-ONEBRN 4382137DTXSID90196067alpha,alpha-Pentamethylen-gamma-butyrolacton [German]alpha,alpha-Pentamethylen-gamma-butyrolactonRefChem:264561DTXCID001185582-Oxaspiro[4.5]decan-1-oneSCHEMBL107033SCHEMBL3197445G73359
Show more names
AE-641/00358005F983214
Database identifiers
- CAS
4420-11-5- PubChem CID
- 20472
- DTXSID
DTXSID90196067- Nikkaji
- J1.769.387E
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 168
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Related reactions
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Compound notes
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