1-[4-(Bromomethyl)phenyl]-2,2-dimethylpropan-1-one

HCID 12831007CAS 52449-32-8

Basic information

Standard SMILES
CC(C)(C)C(=O)c1ccc(CBr)cc1
InChIKey
SNLNKUQSMCQSJL-UHFFFAOYSA-N
Molecular formula
C12H15BrO
Average molar mass
255.15 g/mol
Monoisotopic mass
254.0306272

Names & identifiers

Preferred name
1-[4-(Bromomethyl)phenyl]-2,2-dimethylpropan-1-one
IUPAC
1-[4-(bromomethyl)phenyl]-2,2-dimethylpropan-1-one

Names & synonyms

52449-32-81-[4-(Bromomethyl)phenyl]-2,2-dimethylpropan-1-one1-(4-(bromomethyl)phenyl)-2,2-dimethylpropan-1-one1-Propanone, 1-[4-(bromomethyl)phenyl]-2,2-dimethyl-alpha-bromo-p-pivaloyl toluenealpha-bromo-4-pivaloyl tolueneSCHEMBL2574286DTXSID30510980SNLNKUQSMCQSJL-UHFFFAOYSA-N1-(4-bromomethylphenyl)-2,2-dimethylpropan-1-one

Database identifiers

CAS
52449-32-8
PubChem CID
12831007
DTXSID
DTXSID30510980

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
3
Heavy atoms
14

Related reactions

31 records

Linked notes

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