Basic information
- Standard SMILES
C=C(c1ccc(F)cc1F)[C@H](C)OC1CCCCO1- InChIKey
VIDAKUNVQOATTO-VPHXOMNUSA-N- Molecular formula
- C15H18F2O2
- Average molar mass
- 268.3 g/mol
- Monoisotopic mass
- 268.12748614
Names & identifiers
- Preferred name
- (3S)-2-(2,4-Difluorophenyl)-3-(3,4,5,6-tetrahydro-2H-pyran-2-yloxy)-1-butene
- IUPAC
- 2-[(2S)-3-(2,4-difluorophenyl)but-3-en-2-yl]oxyoxane
Names & synonyms
SCHEMBL7481134VIDAKUNVQOATTO-VPHXOMNUSA-N(3S)-2-(2,4-Difluorophenyl)-3-(3,4,5,6-tetrahydro-2H-pyran-2-yloxy)-1-butene(3S)-2-(2,4-Difluorphenyl)-3-(3,4,5,6-tetrahydro-2H-pyran-2-yloxy)-1-butene
Database identifiers
- PubChem CID
- 70105313
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 309
Related reactions
4 records
Compound notes
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