4-Bromo-2-fluoro-3-methylpyridine

C6H5BrFNCAS 128071-79-4190.02 g/mol

Open in Covalent MOL file
NFBr
Aryl halide

Properties

Molecular formula
C6H5BrFN
Molar mass
190.02 g/mol
Exact mass
188.9589 Da
logP
2.29Crippen estimate
Polar surface area
12.9 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

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

Identifiers

CAS number
128071-79-4
SMILES
CC1=C(C=CN=C1F)Br
InChIKey
YRLGBXZZABNBNL-UHFFFAOYSA-N
InChI
InChI=1S/C6H5BrFN/c1-4-5(7)2-3-9-6(4)8/h2-3H,1H3

Weigh it out

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

Names and synonyms

1 names
  • 2-Fluoro-4-bromo-3-picoline

Work with 4-Bromo-2-fluoro-3-methylpyridine

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

4-Bromo-2,3-dimethylpyridine259807-91-559 % similar 3-Bromo-2-fluoropyridine36178-05-952 % similar 1,4-Dibromo-2,3-dimethylbenzene75024-22-546 % similar 1-Bromo-3-fluoro-2-methylbenzene1422-54-445 % similar 1-Bromo-4-fluoro-2,3-dimethylbenzene52548-00-245 % similar 2,6-Dibromotoluene69321-60-444 % similar 3-Bromo-2-fluoro-6-picoline375368-78-842 % similar 2-Fluoro-3-methylpyridine2369-18-842 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Bromo-4-fluoroaniline1003-98-1 2-Bromo-5-fluorobenzenamine1003-99-2 2-Bromo-3-fluoroaniline111721-75-6 3-Bromo-5-fluoroaniline134168-97-1 3-Bromo-2-fluoro-5-methylpyridine17282-01-8 2-Bromo-6-fluoro-4-methylpyridine180608-37-1 5-Bromo-2-fluorobenzenamine2924-09-6 5-Bromo-2-fluoro-3-methylpyridine29312-98-9

Elsewhere

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