3-Bromo-6-chloro-2-methyl-5-nitropyridine

C₆H₄BrClN₂O₂CAS 186413-75-2251.46 g/mol

Open in Covalent MOL file

Aryl halide Nitro

Properties

Molecular formula: C₆H₄BrClN₂O₂
Molar mass: 251.46 g/mol
Exact mass: 249.9145 Da
logP: 2.71Crippen estimate
Polar surface area: 56.0 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 1

Identifiers

CAS number

186413-75-2

SMILES

Cc1nc(Cl)c([N+](=O)[O-])cc1Br

InChIKey

PVECCSKVOZZRPC-UHFFFAOYSA-N

InChI

InChI=1S/C6H4BrClN2O2/c1-3-4(7)2-5(10(11)12)6(8)9-3/h2H,1H3

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Names and synonyms

1 names

Pyridine, 3-bromo-6-chloro-2-methyl-5-nitro-

Work with 3-Bromo-6-chloro-2-methyl-5-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-Chloro-5-methyl-3-nitropyridine23056-40-850 % similar 2,4-Dichloro-6-methyl-5-nitropyrimidine13162-26-048 % similar 6-Chloro-2-methyl-3-nitropyridine22280-60-048 % similar 6-Bromo-2-methyl-3-nitropyridine22282-96-848 % similar 5-Chloro-2-methyl-3-nitropyridine1211533-93-547 % similar 3-Bromo-2-chloro-5-nitropyridine5470-17-747 % similar 5-Bromo-2-methyl-3-nitropyridine911434-05-447 % similar 2,6-Dichloro-3-nitropyridine16013-85-746 % similar

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

Same formula

2-Bromo-4-chloro-6-nitrobenzenamine827-25-8 3-Bromo-2-chloro-6-methyl-5-nitropyridine856834-95-2 5-Bromo-2-chloro-4-methyl-3-nitropyridine884495-15-2 2-Bromo-6-chloro-4-nitroaniline99-29-6

Elsewhere

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