2-Amino-3-bromo-6-methyl-5-nitropyridine

C₆H₆BrN₃O₂CAS 150935-62-9232.04 g/mol

Open in Covalent MOL file

Aryl halide Nitro Primary amine

Properties

Molecular formula: C₆H₆BrN₃O₂
Molar mass: 232.04 g/mol
Exact mass: 230.9643 Da
logP: 1.64Crippen estimate
Polar surface area: 82.0 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 1

Identifiers

CAS number

150935-62-9

SMILES

CC1=NC(=C(C=C1[N+](=O)[O-])Br)N

InChIKey

QEACSSLDLWHNGC-UHFFFAOYSA-N

InChI

InChI=1S/C6H6BrN3O2/c1-3-5(10(11)12)2-4(7)6(8)9-3/h2H,1H3,(H2,8,9)

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Names and synonyms

1 names

3-Bromo-6-methyl-5-nitropyridin-2-amine

Work with 2-Amino-3-bromo-6-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

3-Bromo-2-chloro-6-methyl-5-nitropyridine856834-95-265 % similar 3-Bromo-6-chloro-2-methyl-5-nitropyridine186413-75-257 % similar 4-Bromo-2,3-dimethyl-6-nitroaniline108485-13-852 % similar 6-Bromo-2-methyl-3-nitropyridine22282-96-851 % similar 2,6-Dimethyl-3-nitropyridine15513-52-750 % similar 3-Bromo-5-nitro-2-pyridinamine15862-31-450 % similar 5-Bromo-2-methyl-3-nitropyridine911434-05-450 % similar 2-Bromo-4-methyl-6-nitrobenzenamine827-24-749 % similar

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

Same formula

2-Amino-5-bromo-4-methyl-3-nitropyridine100367-40-6

Elsewhere

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