6-Bromo-4-nitro-1H-indazole

C₇H₄BrN₃O₂CAS 885518-46-7242.03 g/mol

Open in Covalent MOL file

Aryl halide Nitro

Properties

Molecular formula: C₇H₄BrN₃O₂
Molar mass: 242.03 g/mol
Exact mass: 240.9487 Da
logP: 2.23Crippen estimate
Polar surface area: 71.8 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 1

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

885518-46-7

SMILES

C1=C(C=C(C2=C1NN=C2)[N+](=O)[O-])Br

InChIKey

AHEMYGJJCOXPSP-UHFFFAOYSA-N

InChI

InChI=1S/C7H4BrN3O2/c8-4-1-6-5(3-9-10-6)7(2-4)11(12)13/h1-3H,(H,9,10)

Weigh it out

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Work with 6-Bromo-4-nitro-1H-indazole

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

6-Chloro-4-nitro-1H-indazole885519-50-665 % similar 6-Bromo-4-iodo-1H-indazole885519-41-554 % similar 4-Amino-6-bromo (1H)indazole885518-50-350 % similar 6-Bromo-4-fluoro-1H-indazole885520-23-050 % similar 2,5-Dibromo-3-nitropyridine15862-37-049 % similar 5-Methyl-6-nitro-1H-indazole72521-00-747 % similar 5-Bromo-3-nitro-2(1H)-pyridinone15862-34-747 % similar 5-Bromo-2-chloro-3-nitropyridine67443-38-347 % similar

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

Same formula

2-Amino-3-bromo-5-nitrobenzonitrile17601-94-4 3-Bromo-5-nitro-1H-indazole67400-25-3 3-Bromo-6-nitroindazole70315-68-3 3-Bromo-7-nitroindazole74209-34-0

Elsewhere

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