Basic information
- Standard SMILES
CC(C)CCC(=O)c1ccc(Br)cc1- InChIKey
GLMPHLZHYRJERJ-UHFFFAOYSA-N- Molecular formula
- C12H15BrO
- Average molar mass
- 255.15 g/mol
Names & identifiers
- Preferred name
- 4-(1-Oxo-4-methyl-pentyl) bromobenzene
- IUPAC
- 1-(4-bromophenyl)-4-methylpentan-1-one
Names & synonyms
135883-27-14-(1-oxo-4-methyl-pentyl) bromobenzeneSCHEMBL2850064SCHEMBL16499440SCHEMBL22342286GLMPHLZHYRJERJ-UHFFFAOYSA-N4-(1-oxo-4-methyl-pentyl)bromobenzene1-(4-Bromophenyl)-4-methyl-1-pentanone
Database identifiers
- PubChem CID
- 22409079
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 181
Related reactions
39 records
Compound notes
Loading…