3,6-Difluoro-4-(trifluoromethyl)pyridin-2-amine

C₆H₃F₅N₂CAS 675602-89-8198.10 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide Primary amine

Properties

Molecular formula: C₆H₃F₅N₂
Molar mass: 198.10 g/mol
Exact mass: 198.0216 Da
logP: 1.96Crippen estimate
Polar surface area: 38.9 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Hazards

Danger

H302 Harmful if swallowed83.3% of notifiers
H312 Harmful in contact with skin83.3% of notifiers
H315 Causes skin irritation83.3% of notifiers
H319 Causes serious eye irritation83.3% of notifiers
H331 Toxic if inhaled16.7% of notifiers
H332 Harmful if inhaled66.7% of notifiers
H335 May cause respiratory irritation83.3% of notifiers

Aggregated from 6 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

675602-89-8

SMILES

C1=C(C(=C(N=C1F)N)F)C(F)(F)F

InChIKey

GJYDRBORZUFFEB-UHFFFAOYSA-N

InChI

InChI=1S/C6H3F5N2/c7-3-1-2(6(9,10)11)4(8)5(12)13-3/h1H,(H2,12,13)

Weigh it out

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

Names and synonyms

1 names

2-Amino-3,6-difluoro-4-(trifluoromethyl)pyridine

Work with 3,6-Difluoro-4-(trifluoromethyl)pyridin-2-amine

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

1,2,3,4-Tetrafluoro-5-(trifluoromethyl)benzene654-53-541 % similar 2.3-Difluoro 4-trifluoromethoxyaniline123950-46-939 % similar 5-Bromo-3-(trifluoromethyl)pyridin-2-amine79456-34-138 % similar 2-Fluoro-3-(trifluoromethyl)aniline123973-25-138 % similar 2-Amino-3-(trifluoromethyl)pyridine183610-70-038 % similar 4-Amino-2,6-difluoropyridine63489-58-738 % similar 2,6-Difluoropyrimidin-4-amine675-12-737 % similar 2,4-Diamino-6-fluoropyrimidine696-83-337 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(Pentafluorophenyl)hydrazine828-73-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook