chempirical

2-Amino-5-bromopyridine-3-carbonitrile

C6H4BrN3CAS 709652-82-4198.02 g/mol

Open in Covalent MOL file
NNH2NBr
Aryl halideNitrilePrimary amine

Properties

Molecular formula
C6H4BrN3
Molar mass
198.02 g/mol
Exact mass
196.9589 Da
logP
1.30Crippen estimate
Polar surface area
62.7 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
709652-82-4
SMILES
C1=C(C=NC(=C1C#N)N)Br
InChIKey
UJKZMLZIIIGCMI-UHFFFAOYSA-N
InChI
InChI=1S/C6H4BrN3/c7-5-1-4(2-8)6(9)10-3-5/h1,3H,(H2,9,10)

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Names and synonyms

1 names
  • 2-Amino-5-bromo-nicotinonitrile

Work with 2-Amino-5-bromopyridine-3-carbonitrile

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

5-Bromo-2-chloro-3-pyridinecarbonitrile405224-23-959 % similar 2-Amino-3,5-dibromopyridine35486-42-153 % similar 2,3-Diamino-5-bromopyridine38875-53-553 % similar 2-Amino-5-bromo-3-iodopyridine381233-96-150 % similar 5-Bromo-3-chloropyridin-2-amine38185-55-650 % similar 2-Amino-5-bromo-3-hydroxypyridine39903-01-050 % similar 6-Amino-5-bromo-3-pyridinecarbonitrile477871-32-250 % similar 2-Amino-5-bromo-3-fluoropyridine748812-37-550 % similar

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

Same formula

4-Bromo-1H-pyrazolo[3,4-C]pyridine1032943-43-3 7-Bromo-(1,2,4)triazolo(1,5-a)pyridine1053655-66-5 6-Bromo-[1,2,4]triazolo[4,3-a]pyridine108281-79-4 6-Bromo-1H-pyrazolo[4,3-b]pyridine1150617-54-1 6-Bromoimidazo[1,2-B]pyridazine1159977-65-7 6-Bromo-1H-pyrazolo[4,3-c]pyridine1206973-12-7 5-Bromo-(1,2,4)triazolo(1,5-a)pyridine143329-58-2 5-Bromo-7H-pyrrolo[2,3-D]pyrimidine175791-49-8

Elsewhere

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