3-Bromo-4-fluorobenzenamine

C₆H₅BrFNCAS 656-64-4190.02 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₆H₅BrFN
Molar mass: 190.02 g/mol
Exact mass: 188.9589 Da
Melting point: 34 °C
Boiling point: 235 °C
logP: 2.17Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Identifiers

CAS number

656-64-4

SMILES

Nc1ccc(F)c(Br)c1

InChIKey

KOWPUNQBGWIERF-UHFFFAOYSA-N

InChI

InChI=1S/C6H5BrFN/c7-5-3-4(9)1-2-6(5)8/h1-3H,9H2

Weigh it out

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

Names and synonyms

4 names

Benzenamine, 3-bromo-4-fluoro-
Aniline, 3-bromo-4-fluoro-
3-Bromo-4-fluoroaniline
3-Bromo-4-fluorophenylamine

Work with 3-Bromo-4-fluorobenzenamine

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

3,4-Difluoroaniline3863-11-460 % similar 3,4-Dibromobenzenamine615-55-460 % similar 2,4-Dibromo-1-fluorobenzene1435-53-656 % similar 1-Bromo-2,5-difluorobenzene399-94-056 % similar 4-Fluoro-1,3-phenylenediamine6264-67-156 % similar 3-Bromo-4,5-difluorobenzenamine875664-41-855 % similar 4-Amino-2-bromophenol16750-67-752 % similar 2-Bromo-4-chloro-1-fluorobenzene1996-30-152 % 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 5-Bromo-2-fluorobenzenamine2924-09-6 4-Bromo-2-fluoroaniline367-24-8

Elsewhere

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