2,3-Difluoroaniline

C₆H₅F₂NCAS 4519-40-8129.11 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₆H₅F₂N
Molar mass: 129.11 g/mol
Exact mass: 129.0390 Da
Boiling point: 69 °C (at 12 Torr)
logP: 1.55Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Identifiers

CAS number

4519-40-8

SMILES

Nc1cccc(F)c1F

InChIKey

YCCQGFYAVUTQFK-UHFFFAOYSA-N

InChI

InChI=1S/C6H5F2N/c7-4-2-1-3-5(9)6(4)8/h1-3H,9H2

Weigh it out

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

Names and synonyms

4 names

Benzenamine, 2,3-difluoro-
Aniline, 2,3-difluoro-
2,3-Difluorobenzenamine
2,3-Difluorophenylamine

Work with 2,3-Difluoroaniline

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

2,3,4-Trifluoroaniline3862-73-563 % similar 2-Fluoroaniline348-54-961 % similar 3-Chloro-2-fluorobenzenamine2106-04-958 % similar 2-Chloro-3-fluorobenzenamine21397-08-058 % similar 3-Fluoro-2-methylaniline443-86-758 % similar 3-Bromo-2-fluorobenzenamine58534-95-558 % similar 2-Bromo-3-fluoroaniline111721-75-656 % similar 2-Amino-6-fluorophenol53981-25-256 % similar

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

Same formula

2,4-Difluoroaniline367-25-9 2,5-Difluoroaniline367-30-6 3,5-Difluoroaniline372-39-4 3,4-Difluoroaniline3863-11-4 2,6-Difluoroaniline5509-65-9

Elsewhere

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