Basic information
- Standard SMILES
O=C1c2cc(OCCCF)ccc2CC12CCC(O)CC2- InChIKey
VQNLKBZLYGTKTN-UHFFFAOYSA-N- Molecular formula
- C17H21FO3
- Average molar mass
- 292.34 g/mol
- Monoisotopic mass
- 292.14747269
Names & identifiers
- Preferred name
- 6'-(3-Fluoropropoxy)-4-hydroxyspiro[cyclohexane-1,2'-inden]-1'(3'H)-one
- IUPAC
- 6-(3-fluoropropoxy)-4'-hydroxyspiro[3H-indene-2,1'-cyclohexane]-1-one
Names & synonyms
6'-(3-Fluoropropoxy)-4-hydroxyspiro[cyclohexane-1,2'-inden]-1'(3'H)-one1383985-34-9SCHEMBL9948622VQNLKBZLYGTKTN-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 67979648
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 376
Related reactions
10 records
Compound notes
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