2,6-Difluoroaniline

C₆H₅F₂NCAS 5509-65-9129.11 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: 51–52 °C (at 15 Torr)
logP: 1.55Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Identifiers

CAS number

5509-65-9

SMILES

Nc1c(F)cccc1F

InChIKey

ODUZJBKKYBQIBX-UHFFFAOYSA-N

InChI

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

Weigh it out

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

Names and synonyms

6 names

Benzenamine, 2,6-difluoro-
Aniline, 2,6-difluoro-
2,6-Difluorobenzenamine
NSC 127234
2,6-Difluorobenzeneamine
2,6-Difluorophenylamine

Work with 2,6-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-Chloro-6-fluoroaniline363-51-968 % similar 2-Bromo-6-fluorobenzenamine65896-11-968 % similar 2-Amino-3-fluorobenzonitrile115661-37-558 % similar 4-Chloro-2,6-difluorobenzenamine69411-06-952 % similar 2-Fluoro-6-nitrobenzenamine17809-36-852 % similar 2-Fluoroaniline348-54-950 % similar 2,4,6-Trifluorobenzenamine363-81-550 % similar 1,2-Difluorobenzene367-11-350 % 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 2,3-Difluoroaniline4519-40-8

Elsewhere

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