Basic information
- Standard SMILES
CC1(C)COC(CCC(O)c2ccc(F)cc2)OC1- InChIKey
UJBNJJPRERSGDJ-UHFFFAOYSA-N- Molecular formula
- C15H21FO3
- Average molar mass
- 268.32 g/mol
Names & identifiers
- Preferred name
- 3-(5,5-Dimethyl-1,3-dioxan-2-yl)-1-(4-fluorophenyl)propan-1-ol
- IUPAC
- 3-(5,5-dimethyl-1,3-dioxan-2-yl)-1-(4-fluorophenyl)propan-1-ol
Names & synonyms
SCHEMBL5069844UJBNJJPRERSGDJ-UHFFFAOYSA-N3-(5,5-dimethyl-1,3-dioxan-2-yl)-1-(4-fluorophenyl)propan-1-olalpha-(4-fluorophenyl)-5,5-dimethyl-1,3-dioxane-2-propanol
Database identifiers
- PubChem CID
- 10707014
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 265
Related reactions
12 records
Compound notes
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