5-Bromo-2-methyl-3-nitropyridine

C₆H₅BrN₂O₂CAS 911434-05-4217.02 g/mol

Open in Covalent MOL file

Aryl halide Nitro

Properties

Molecular formula: C₆H₅BrN₂O₂
Molar mass: 217.02 g/mol
Exact mass: 215.9534 Da
logP: 2.06Crippen estimate
Polar surface area: 56.0 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 1

Identifiers

CAS number

911434-05-4

SMILES

Cc1ncc(Br)cc1[N+](=O)[O-]

InChIKey

FZZLWWNOYMHSIS-UHFFFAOYSA-N

InChI

InChI=1S/C6H5BrN2O2/c1-4-6(9(10)11)2-5(7)3-8-4/h2-3H,1H3

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

Names and synonyms

1 names

Pyridine, 5-bromo-2-methyl-3-nitro-

Work with 5-Bromo-2-methyl-3-nitropyridine

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

2,5-Dibromo-3-nitropyridine15862-37-066 % similar 5-Chloro-2-methyl-3-nitropyridine1211533-93-562 % similar 5-Bromo-3-nitro-2(1H)-pyridinone15862-34-762 % similar 5-Bromo-3-nitro-2-pyridinamine6945-68-262 % similar 4-Bromo-1-methyl-2-nitrobenzene60956-26-553 % similar 4-Bromo-1,2-dinitrobenzene610-38-850 % similar 3-Bromo-2-chloro-6-methyl-5-nitropyridine856834-95-250 % similar 4-Bromo-2-methyl-6-nitrobenzenamine77811-44-049 % similar

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

Same formula

5-Bromo-2-methylpyrimidine-4-carboxylic acid100707-39-9 2-Bromo-5-nitroaniline10403-47-1 2-Bromo-4-nitrobenzenamine13296-94-1 6-Bromo-2-methyl-3-nitropyridine22282-96-8 2-Bromo-4-methyl-5-nitropyridine23056-47-5 2-Bromo-6-methyl-3-nitropyridine374633-31-5 4-Bromo-3-nitrobenzenamine53324-38-2 2-Bromo-6-nitrobenzenamine59255-95-7

Elsewhere

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