chempirical

3-Bromo-2-fluoro-6-picoline

C6H5BrFNCAS 375368-78-8190.02 g/mol

Open in Covalent MOL file
NBrF
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

Identifiers

CAS number
375368-78-8
SMILES
CC1=NC(=C(C=C1)Br)F
InChIKey
ZFXJNYKHLITMJY-UHFFFAOYSA-N
InChI
InChI=1S/C6H5BrFN/c1-4-2-3-5(7)6(8)9-4/h2-3H,1H3

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Names and synonyms

1 names
  • 3-Bromo-2-fluoro-6-methylpyridine

Work with 3-Bromo-2-fluoro-6-picoline

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-Dibromo-6-methylpyridine261373-04-057 % similar 3-Bromo-2,6-dimethylpyridine3430-31-757 % similar 2-Amino-3-bromo-6-methylpyridine126325-46-053 % similar 3-Bromo-2-chloro-6-picoline185017-72-553 % similar 3-Amino-2-fluoro-6-methylpyridine374633-34-853 % similar 2-Bromo-3-fluoro-6-picoline374633-36-048 % similar 2-Fluoro-6-methyl-3-nitropyridine19346-45-344 % similar 3-Bromo-6-fluoro-2-methylpyridine375368-83-544 % 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 4-Bromo-2-fluoro-3-methylpyridine128071-79-4 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

Elsewhere

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