3'-pyridin-4-ylspiro[3H-indene-2,2'-oxirane]-1-one
Basic information
- CAS
54714-71-5- Standard SMILES
O=C1c2ccccc2CC12OC2c1ccncc1- InChIKey
BLYANTLEYGWVNY-UHFFFAOYSA-N- Molecular formula
- C15H11NO2
- Average molar mass
- 237.25 g/mol
- Monoisotopic mass
- 237.07897859
Names & identifiers
- Preferred name
- 3'-pyridin-4-ylspiro[3H-indene-2,2'-oxirane]-1-one
- IUPAC
- 3'-pyridin-4-ylspiro[3H-indene-2,2'-oxirane]-1-one
Names & synonyms
54714-71-53'-pyridin-4-ylspiro[3H-indene-2,2'-oxirane]-1-oneNSC270030SCHEMBL11856698DTXSID10313416NSC-2700303'-(Pyridin-4-yl)spiro[indene-2,2'-oxiran]-1(3H)-one
Database identifiers
- CAS
54714-71-5- PubChem CID
- 320895
- DTXSID
DTXSID10313416
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 364
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Compound notes
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