Spiro[pyrrolidine-3,9'-[9H]xanthen]-2-one, 1-butyl-
Basic information
- CAS
648928-56-7- Standard SMILES
CCCCN1CCC2(C1=O)c1ccccc1Oc1ccccc12- InChIKey
OVJDKJWDKQGGCE-UHFFFAOYSA-N- Molecular formula
- C20H21NO2
- Average molar mass
- 307.4 g/mol
- Monoisotopic mass
- 307.15722891
Names & identifiers
- Preferred name
- Spiro[pyrrolidine-3,9'-[9H]xanthen]-2-one, 1-butyl-
- IUPAC
- 1-butylspiro[pyrrolidine-3,9'-xanthene]-2-one
Names & synonyms
648928-56-7Spiro[pyrrolidine-3,9'-[9H]xanthen]-2-one, 1-butyl-1-butylspiro[pyrrolidine-3,9'-xanthen]-2-oneDTXSID30458878
Database identifiers
- CAS
648928-56-7- PubChem CID
- 11209010
- DTXSID
DTXSID30458878- Nikkaji
- J1.974.755G
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 427
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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