chempirical

3-Fluoroaniline

C6H6FNCAS 372-19-0111.12 g/mol

Open in Covalent MOL file
H2NF
Aryl halidePrimary amine

Properties

Molecular formula
C6H6FN
Molar mass
111.12 g/mol
Exact mass
111.0484 Da
Density
1.16 g/mL (at 15.8 °C)
Melting point
−5 °C
Boiling point
188 °C
logP
1.41Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
372-19-0
SMILES
Nc1cccc(F)c1
InChIKey
QZVQQUVWFIZUBQ-UHFFFAOYSA-N
InChI
InChI=1S/C6H6FN/c7-5-2-1-3-6(8)4-5/h1-4H,8H2

Weigh it out

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

Names and synonyms

9 names
  • Benzenamine, 3-fluoro-
  • Aniline, m-fluoro-
  • 3-Fluorobenzenamine
  • m-Fluorophenylamine
  • 1-Amino-3-fluorobenzene
  • m-Fluoroaniline
  • 3-Fluorophenylamine
  • NSC 10300
  • 4-Amino-2-fluorobenzene

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

Similar compounds

M-Phenylenediamine108-45-263 % similar 4'-Fluoro(1,1'-biphenyl)-3-amine10540-45-162 % similar 1,3-Difluorobenzene372-18-958 % similar 3,5-Difluoroaniline372-39-457 % similar M-Phenylenediamine hydrochloride541-69-555 % similar 3-Chloroaniline108-42-950 % similar 3,3′-Difluoro-1,1′-biphenyl396-64-550 % similar 3-Chloro-5-fluorobenzenamine4863-91-650 % similar

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

Same formula

2-Fluoro-3-methylpyridine2369-18-8 2-Fluoro-5-methylpyridine2369-19-9 2-Fluoroaniline348-54-9 4-Fluoroaniline371-40-4 2-Fluoro-6-methylpyridine407-22-7 2-Fluoro-4-methylpyridine461-87-0

Elsewhere

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