Basic information
- Standard SMILES
Brc1cccc(OCC2CCCCCC2)c1- InChIKey
IYYYRYIHBWHEEA-UHFFFAOYSA-N- Molecular formula
- C14H19BrO
- Average molar mass
- 283.2 g/mol
Names & identifiers
- Preferred name
- ((3-Bromophenoxy)methyl)cycloheptane
- IUPAC
- (3-bromophenoxy)methylcycloheptane
Names & synonyms
SCHEMBL2209407IYYYRYIHBWHEEA-UHFFFAOYSA-N((3-bromophenoxy)methyl)cycloheptane
Database identifiers
- PubChem CID
- 67317652
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 187
Related reactions
11 records
Compound notes
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