Basic information
- Standard SMILES
BrCc1ccc(Br)c(OC2CCCCO2)c1- InChIKey
LSHFTBBTEHEIKF-UHFFFAOYSA-N- Molecular formula
- C12H14Br2O2
- Average molar mass
- 350.05 g/mol
- Monoisotopic mass
- 347.93605
Names & identifiers
- Preferred name
- 4-Bromo-3-(tetrahydropyran-2-yloxy)benzyl bromide
- IUPAC
- 2-[2-bromo-5-(bromomethyl)phenoxy]oxane
Names & synonyms
SCHEMBL2060182LSHFTBBTEHEIKF-UHFFFAOYSA-N4-bromo-3-(tetrahydropyran-2-yloxy)benzyl bromide
Database identifiers
- PubChem CID
- 16747842
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 213
Related reactions
4 records
Linked notes
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