chempirical

4-Bromo-3-fluoroaniline

C6H5BrFNCAS 656-65-5190.02 g/mol

Open in Covalent MOL file
H2NFBr
Aryl halidePrimary amine

Properties

Molecular formula
C6H5BrFN
Molar mass
190.02 g/mol
Exact mass
188.9589 Da
logP
2.17Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

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
656-65-5
SMILES
C1=CC(=C(C=C1N)F)Br
InChIKey
YTMVYYAKOPIJCZ-UHFFFAOYSA-N
InChI
InChI=1S/C6H5BrFN/c7-5-2-1-4(9)3-6(5)8/h1-3H,9H2

Weigh it out

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

Work with 4-Bromo-3-fluoroaniline

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-4-fluorobenzenamine656-64-469 % similar 3,4-Difluoroaniline3863-11-460 % similar 3,4-Dibromobenzenamine615-55-460 % similar 1,4-Dibromo-2-fluorobenzene1435-52-556 % similar 1-Bromo-2,4-difluorobenzene348-57-256 % similar 3-Bromo-4,5-difluorobenzenamine875664-41-855 % similar 1,5-Dibromo-2,4-difluorobenzene28342-75-854 % similar 4-Bromo-3,5-difluoroaniline203302-95-852 % similar

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

Same formula

2-Bromo-4-fluoroaniline1003-98-1 2-Bromo-5-fluorobenzenamine1003-99-2 2-Bromo-3-fluoroaniline111721-75-6 4-Bromo-2-fluoro-3-methylpyridine128071-79-4 3-Bromo-5-fluoroaniline134168-97-1 3-Bromo-2-fluoro-5-methylpyridine17282-01-8 2-Bromo-6-fluoro-4-methylpyridine180608-37-1 5-Bromo-2-fluorobenzenamine2924-09-6

Elsewhere

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