Basic information
- Standard SMILES
Cc1cc(OC2CCOCC2)cc(C)c1Br- InChIKey
GUHJVUYMKUEOIX-UHFFFAOYSA-N- Molecular formula
- C13H17BrO2
- Average molar mass
- 285.18 g/mol
Names & identifiers
- Preferred name
- 4-(4-Bromo-3,5-dimethylphenoxy)tetrahydro-2H-pyran
- IUPAC
- 4-(4-bromo-3,5-dimethylphenoxy)oxane
Names & synonyms
4-(4-Bromo-3,5-dimethylphenoxy)tetrahydro-2H-pyran1458652-70-4SCHEMBL15262629GUHJVUYMKUEOIX-UHFFFAOYSA-N4-(4-bromo-3,5-dimethylphenoxy)oxaneDB-1663484-(4-Bromo-3,5-dimethylphenoxy)-tetrahydropyranA1-40452
Database identifiers
- PubChem CID
- 86697115
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 204
Related reactions
3 records
Compound notes
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