3-Bromo-5-fluoro-2-methoxypyridine

C₆H₅BrFNOCAS 884494-81-9206.01 g/mol

Open in Covalent MOL file

Aryl halide Ether

Properties

Molecular formula: C₆H₅BrFNO
Molar mass: 206.01 g/mol
Exact mass: 204.9539 Da
logP: 1.99Crippen estimate
Polar surface area: 22.1 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 1

Hazards

Warning

H302+H312+H332 Harmful if swallowed, in contact with skin or if inhaled25% of notifiers
H302 Harmful if swallowed75% of notifiers
H312 Harmful in contact with skin75% of notifiers
H315 Causes skin irritation50% of notifiers
H319 Causes serious eye irritation50% of notifiers
H332 Harmful if inhaled75% of notifiers
H335 May cause respiratory irritation25% of notifiers

Aggregated from 4 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, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

884494-81-9

SMILES

COc1ncc(F)cc1Br

InChIKey

HSWCOAGQYSBFAK-UHFFFAOYSA-N

InChI

InChI=1S/C6H5BrFNO/c1-10-6-5(7)2-4(8)3-9-6/h2-3H,1H3

Weigh it out

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

Names and synonyms

1 names

Pyridine, 3-bromo-5-fluoro-2-methoxy-

Work with 3-Bromo-5-fluoro-2-methoxypyridine

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

3,5-Dibromo-2-methoxypyridine13472-60-163 % similar 3-Bromo-5-chloro-2-methoxy-pyridine102830-75-159 % similar 5-Amino-3-bromo-2-methoxypyridine53242-18-559 % similar 3-Bromo-2-methoxy-5-(trifluoromethyl)pyridine124432-63-958 % similar 5-Fluoro-2-methoxynicotinaldehyde351410-62-354 % similar 2,3-Dibromo-5-fluoropyridine878207-82-053 % similar 5-Fluoro-2-methoxynicotinic acid884494-82-051 % similar 3-Bromo-2-methoxy-5-nitropyridine15862-50-750 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Methoxy-3-fluoro-5-bromopyridine124432-70-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook