3-Bromo-7-nitroindazole

C₇H₄BrN₃O₂CAS 74209-34-0242.03 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

Danger

H360 May damage fertility or the unborn child100% of notifiers

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P280, P318, P405, P501

Identifiers

CAS number

74209-34-0

SMILES

C1=CC2=C(NN=C2C(=C1)[N+](=O)[O-])Br

InChIKey

NFSTZPMYAZRZPC-UHFFFAOYSA-N

InChI

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

Weigh it out

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

Work with 3-Bromo-7-nitroindazole

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

1,5-Dinitronaphthalene605-71-051 % similar 1-Bromo-5-nitronaphthalene5328-76-751 % similar 7-Nitroindazole2942-42-950 % similar 4-Benzyl-10,19-diethyl-4,10,19-triaza-1,7,13,16-tetraoxacycloheneicosane397864-11-848 % similar 4-Nitro-1H-indazole2942-40-747 % similar 1-Nitronaphthalene86-57-746 % similar 2-Bromo-3-nitrotoluene41085-43-245 % similar 8-Nitroquinoline607-35-245 % 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 6-Bromo-4-nitro-1H-indazole885518-46-7

Elsewhere

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