Spiro[4.7]dodecan-6-one
Basic information
- CAS
3002-04-8- Standard SMILES
O=C1CCCCCCC12CCCC2- InChIKey
ZIBHAUBCYMTZOT-UHFFFAOYSA-N- Molecular formula
- C12H20O
- Average molar mass
- 180.29 g/mol
- Monoisotopic mass
- 180.15141526
Names & identifiers
- Preferred name
- Spiro[4.7]dodecan-6-one
- IUPAC
- spiro[4.7]dodecan-12-one
Names & synonyms
Spiro[4.7]dodecan-6-one3002-04-8NSC135332DTXSID60300194AKOS024321360NSC-135332DS-012444
Database identifiers
- CAS
3002-04-8- PubChem CID
- 282156
- DTXSID
DTXSID60300194- Nikkaji
- J567.826I
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 189
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Related reactions
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Compound notes
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