5-Bromo-2-(trifluoromethyl)pyridine

C₆H₃BrF₃NCAS 436799-32-5226.00 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide

Properties

Molecular formula: C₆H₃BrF₃N
Molar mass: 226.00 g/mol
Exact mass: 224.9401 Da
logP: 2.86Crippen estimate
Polar surface area: 12.9 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Identifiers

CAS number

436799-32-5

SMILES

C1=CC(=NC=C1Br)C(F)(F)F

InChIKey

RPFAUCIXZGMCFN-UHFFFAOYSA-N

InChI

InChI=1S/C6H3BrF3N/c7-4-1-2-5(11-3-4)6(8,9)10/h1-3H

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

Names and synonyms

1 names

2-Trifluoromethyl-5-bromopyridine

Work with 5-Bromo-2-(trifluoromethyl)pyridine

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

6-(Trifluoromethyl)-3-pyridinol216766-12-059 % similar 5-Amino-2-(trifluoromethyl)pyridine106877-33-253 % similar 5-Cyano-2-(trifluoromethyl)pyridine216431-85-548 % similar 5-Methoxy-2-(trifluoromethyl)pyridine216766-13-148 % similar 6-(Trifluoromethyl)pyridine-3-methanol386704-04-748 % similar 6-(Trifluoromethyl)pyridine-3-carboxaldehyde386704-12-748 % similar 5-(Chloromethyl)-2-(trifluoromethyl)pyridine386715-33-948 % similar 5-(Aminomethyl)-2-(trifluoromethyl)pyridine387350-39-248 % similar

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

Same formula

6-Bromo-2,3,4-trifluorobenzenamine122375-82-0 2-Bromo-3,4,6-trifluoroaniline1481-21-6 2-Bromo-4-(trifluoromethyl)pyridine175205-81-9 2-Bromo-3-(trifluoromethyl)pyridine175205-82-0 2-Bromo-6-(trifluoromethyl)pyridine189278-27-1 3-Bromo-5-(trifluoromethyl)pyridine436799-33-6 2-Bromo-5-(trifluoromethyl)pyridine50488-42-1

Elsewhere

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