Basic information
- CAS
193480-42-1- Standard SMILES
Fc1ccc(C2CCC3(CC2)CO3)cc1- InChIKey
IHNPWNWRRVHBIL-UHFFFAOYSA-N- Molecular formula
- C13H15FO
- Average molar mass
- 206.26 g/mol
- Monoisotopic mass
- 206.11069326
Names & identifiers
- Preferred name
- (3r,6r)-6-(4-Fluorophenyl)-1-oxaspiro[2.5]octane
- IUPAC
- 6-(4-fluorophenyl)-1-oxaspiro[2.5]octane
Names & synonyms
DTXSID101239415193480-42-1(3r,6r)-6-(4-Fluorophenyl)-1-oxaspiro[2.5]octane(3I+/-,6I(2))-6-(4-Fluorophenyl)-1-oxaspiro[2.5]octane
Database identifiers
- CAS
193480-42-1- PubChem CID
- 15329849
- DTXSID
DTXSID101239415
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 225
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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