chempirical

5-Bromo-2-hydroxybenzophenone

C13H9BrO2CAS 55082-33-2277.12 g/mol

Open in Covalent MOL file
OBrOH
Aryl halideKetonePhenol

Properties

Molecular formula
C13H9BrO2
Molar mass
277.12 g/mol
Exact mass
275.9786 Da
logP
3.39Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
55082-33-2
SMILES
C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Br)O
InChIKey
IVIICRNXAGUXLR-UHFFFAOYSA-N
InChI
InChI=1S/C13H9BrO2/c14-10-6-7-12(15)11(8-10)13(16)9-4-2-1-3-5-9/h1-8,15H

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 5-Bromo-2-hydroxybenzophenone

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4,6-Dibenzoylresorcinol3088-15-165 % similar 2-Hydroxy-5-methylbenzophenone1470-57-163 % similar 2-Amino-5-bromobenzophenone39859-36-463 % similar Benzophenone 785-19-863 % similar 2-Hydroxybenzophenone117-99-762 % similar 2,4-Dihydroxybenzophenone131-56-658 % similar 3-Bromobenzophenone1016-77-957 % similar 5-Bromosalicylic acid89-55-457 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook