3',5'-Dibromo-2'-hydroxyacetophenone

C₈H₆Br₂O₂CAS 22362-66-9293.94 g/mol

Open in Covalent MOL file

Aryl halide Ketone Phenol

Properties

Molecular formula: C₈H₆Br₂O₂
Molar mass: 293.94 g/mol
Exact mass: 291.8735 Da
logP: 3.12Crippen estimate
Polar surface area: 37.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

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

22362-66-9

SMILES

CC(=O)C1=C(C(=CC(=C1)Br)Br)O

InChIKey

RCKHUOIKVIOMGZ-UHFFFAOYSA-N

InChI

InChI=1S/C8H6Br2O2/c1-4(11)6-2-5(9)3-7(10)8(6)12/h2-3,12H,1H3

Weigh it out

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Work with 3',5'-Dibromo-2'-hydroxyacetophenone

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

3'-Bromo-5'-chloro-2'-hydroxyacetophenone59443-15-166 % similar 3,5-Dibromosalicylic acid3147-55-565 % similar 5′-Bromo-2′-hydroxyacetophenone1450-75-560 % similar 5'-Bromo-2'-hydroxy-3'-nitroacetophenone70978-54-060 % similar Methyl 3,5-dibromosalicylate21702-79-459 % similar 1-(3-Bromo-2-hydroxyphenyl)ethanone1836-05-159 % similar 1-(4-Bromo-2-hydroxyphenyl)ethan-1-one30186-18-656 % similar 2,4,6-Tribromophenol118-79-655 % similar

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

Same formula

2,5-Dibromobenzeneacetic acid203314-28-7 3′,5′-Dibromo-4′-hydroxyacetophenone2887-72-1 Methyl 3,5-dibromobenzoate51329-15-8 Methyl 2,5-dibromobenzoate57381-43-8 3,5-Dibromo-4-methylbenzoic acid67973-32-4

Elsewhere

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