chempirical

1-Bromo-2-fluoro-3-methoxybenzene

C7H6BrFOCAS 295376-21-5205.03 g/mol

Open in Covalent MOL file
OBrF
Aryl halideEther

Properties

Molecular formula
C7H6BrFO
Molar mass
205.03 g/mol
Exact mass
203.9586 Da
logP
2.60Crippen estimate
Polar surface area
9.2 Ų
H-bond donors / acceptors
0 / 1
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
295376-21-5
SMILES
COC1=C(C(=CC=C1)Br)F
InChIKey
USVPQAWBFVANTN-UHFFFAOYSA-N
InChI
InChI=1S/C7H6BrFO/c1-10-6-4-2-3-5(8)7(6)9/h2-4H,1H3

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Names and synonyms

1 names
  • 3-Bromo-2-fluoroanisole

Work with 1-Bromo-2-fluoro-3-methoxybenzene

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

1,2-Difluoro-3-methoxybenzene134364-69-562 % similar 3-Chloro-2-fluoroanisole261762-56-560 % similar 2-Bromoanisole578-57-459 % similar 1-Bromo-2,3-dimethoxybenzene5424-43-159 % similar 1-Bromo-3-methoxy-2-methylbenzene31804-36-157 % similar 2-Bromo-1,3-dimethoxybenzene16932-45-954 % similar 2-Bromo-3-fluoroanisole446-59-353 % similar 2-Fluoro-3-methoxybenzaldehyde103438-88-653 % 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 4-Bromo-2-fluorobenzyl alcohol188582-62-9 2-Bromo-5-fluorobenzenemethanol202865-66-5 (3-Bromo-5-fluorophenyl)methanol216755-56-5 (4-Bromo-3-fluorophenyl)methanol222978-01-0 2-Bromo-4-fluorobenzyl alcohol229027-89-8 4-Bromo-2-fluoroanisole2357-52-0

Elsewhere

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