Molecular Identity
p-Bromoacetophenone
1-(4-bromophenyl)ethanone
PubChem CID: 7466
2D Structure
Properties
C8H7BrO
Molecular Formula
199.04
Molecular Weight
g/mol
197.9680
Exact Mass
Da
2.4
XLogP
Drug-like (Lipinski: < 5)
17.1
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
1
H-Bond Acceptors
125
Complexity
SMILES
Canonical SMILES
SMILES: CC(=O)C1=CC=C(C=C1)BrIsomeric SMILES
SMILES: CC(=O)C1=CC=C(C=C1)BrSynonyms(20)
4'-Bromoacetophenone99-90-11-(4-Bromophenyl)ethanonep-Bromoacetophenone4-BROMOACETOPHENONEEthanone, 1-(4-bromophenyl)-Methyl p-bromophenyl ketoneAcetophenone, 4'-bromo-7NB3XRY0C6DTXSID4059203NSC-17541RefChem:95935DTXCID4049113202-799-31-(4-bromophenyl)ethan-1-one
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to p-Bromoacetophenone
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