chempirical

(3-Bromo-5-fluorophenyl)methanol

C7H6BrFOCAS 216755-56-5205.03 g/mol

Open in Covalent MOL file
HOFBr
AlcoholAryl halide

Properties

Molecular formula
C7H6BrFO
Molar mass
205.03 g/mol
Exact mass
203.9586 Da
logP
2.08Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
216755-56-5
SMILES
OCc1cc(F)cc(Br)c1
InChIKey
KQWBQTOZXPPFIY-UHFFFAOYSA-N
InChI
InChI=1S/C7H6BrFO/c8-6-1-5(4-10)2-7(9)3-6/h1-3,10H,4H2

Weigh it out

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

Names and synonyms

3 names
  • Benzenemethanol, 3-bromo-5-fluoro-
  • 3-Bromo-5-fluorobenzenemethanol
  • 3-Bromo-5-fluorobenzyl alcohol

Work with (3-Bromo-5-fluorophenyl)methanol

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

1-Bromo-3-(bromomethyl)-5-fluorobenzene216755-57-662 % similar 1,3-Dibromo-5-fluorobenzene1435-51-456 % similar 1-Bromo-3,5-difluorobenzene461-96-156 % similar 3-Fluorobenzyl alcohol456-47-350 % similar 3-Bromobenzenemethanol15852-73-048 % similar 5-Fluoro-3-pyridinemethanol22620-32-247 % similar 3-Bromo-5-fluorobenzonitrile179898-34-145 % similar 1-Bromo-3-fluoro-5-methylbenzene202865-83-645 % similar

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

Same formula

4-Bromo-1-fluoro-2-methoxybenzene103291-07-2 3-Bromo-4-fluoroanisole1161497-23-9 2-Bromo-5-fluorobenzenemethanol202865-66-5 4-Bromo-2-fluoroanisole2357-52-0 2-Bromo-4-fluoro-1-methoxybenzene452-08-4 1-Bromo-2-fluoro-4-methoxybenzene458-50-4 3-Bromo-4-fluorobenzenemethanol77771-03-0 5-Bromo-2-fluorobenzenemethanol99725-13-0

Elsewhere

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