5-Bromo-3-(trifluoromethyl)pyridin-2-amine

C₆H₄BrF₃N₂CAS 79456-34-1241.01 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide Primary amine

Properties

Molecular formula: C₆H₄BrF₃N₂
Molar mass: 241.01 g/mol
Exact mass: 239.9510 Da
logP: 2.45Crippen estimate
Polar surface area: 38.9 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Hazards

Danger

H301 Toxic if swallowed33.3% of notifiers
H302 Harmful if swallowed33.3% of notifiers
H315 Causes skin irritation66.7% of notifiers
H319 Causes serious eye irritation66.7% of notifiers
H335 May cause respiratory irritation33.3% of notifiers

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

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

Identifiers

CAS number

79456-34-1

SMILES

Nc1ncc(Br)cc1C(F)(F)F

InChIKey

QUYZBNHTYCLZLW-UHFFFAOYSA-N

InChI

InChI=1S/C6H4BrF3N2/c7-3-1-4(6(8,9)10)5(11)12-2-3/h1-2H,(H2,11,12)

Weigh it out

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

Names and synonyms

4 names

2-Pyridinamine, 5-bromo-3-(trifluoromethyl)-
5-Bromo-3-(trifluoromethyl)-2-pyridinamine
(5-Bromo-3-trifluoromethylpyridin-2-yl)amine
2-Amino-5-bromo-3-(trifluoromethyl)pyridine

Work with 5-Bromo-3-(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

5-Bromo-3-(trifluoromethyl)-2(1H)-pyridinone76041-79-759 % similar 2-Amino-5-bromo-3-hydroxypyridine39903-01-055 % similar 2-Amino-5-bromo-3-fluoropyridine748812-37-555 % similar 5-Bromo-2-methoxy-3-(trifluoromethyl)pyridine1214377-42-054 % similar 5-Bromo-3-(trifluoromethyl)-2-pyridinecarbonitrile1214377-57-754 % similar 3,5-Dibromo-2-pyridylamine35486-42-153 % similar 5-Bromopyridine-2,3-diamine38875-53-553 % similar 2-Amino-5-bromo-3-iodopyridine381233-96-150 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Amino-3-bromo-5-(trifluoromethyl)-pyridine79456-30-7 5-Bromo-6-trifluoromethyl-pyridin-2-ylamine882500-21-2 5-Bromo-4-(trifluoromethyl)pyridin-2-amine944401-56-3

Elsewhere

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