3-Bromo-2-chloro-5-(trifluoromethyl)pyridine

C6H2BrClF3NCAS 71701-92-3260.44 g/mol

Open in Covalent MOL file
NBrClFFF
Alkyl halideAryl halide

Properties

Molecular formula
C6H2BrClF3N
Molar mass
260.44 g/mol
Exact mass
258.9011 Da
logP
3.52Crippen estimate
Polar surface area
12.9 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

Hazards

Danger
Acute Toxic (GHS06)Irritant (GHS07)

Aggregated from 69 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

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

Identifiers

CAS number
71701-92-3
SMILES
C1=C(C=NC(=C1Br)Cl)C(F)(F)F
InChIKey
GVQLMGPWTHAUPV-UHFFFAOYSA-N
InChI
InChI=1S/C6H2BrClF3N/c7-4-1-3(6(9,10)11)2-12-5(4)8/h1-2H

Weigh it out

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

Work with 3-Bromo-2-chloro-5-(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

2,3-Dichloro-5-(trifluoromethyl)pyridine69045-84-763 % similar 2,3-Dibromo-5-(trifluoromethyl)pyridine79623-38-463 % similar 3-Bromo-2-fluoro-5-(trifluoromethyl)pyridine1031929-01-761 % similar 2-Chloro-3-fluoro-5-(trifluoromethyl)pyridine72600-67-061 % similar 2-Chloro-5-(trifluoromethyl)pyridin-3-amine72587-18-959 % similar 2-Amino-3-bromo-5-(trifluoromethyl)-pyridine79456-30-759 % similar 3-Bromo-2-chloro-5-fluoropyridine884494-36-455 % similar 3-Bromo-2-methoxy-5-(trifluoromethyl)pyridine124432-63-954 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Bromo-3-chloro-5-(trifluoromethyl)pyridine75806-84-7 5-Bromo-2-chloro-4-(trifluoromethyl)pyridine823221-93-8

Elsewhere

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