4-Amino-6-bromo (1H)indazole

C₇H₆BrN₃CAS 885518-50-3212.05 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₇H₆BrN₃
Molar mass: 212.05 g/mol
Exact mass: 210.9745 Da
logP: 1.91Crippen estimate
Polar surface area: 54.7 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 0

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

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

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

885518-50-3

SMILES

C1=C(C=C2C(=C1N)C=NN2)Br

InChIKey

JORDVWJEXMDSBI-UHFFFAOYSA-N

InChI

InChI=1S/C7H6BrN3/c8-4-1-6(9)5-3-10-11-7(5)2-4/h1-3H,9H2,(H,10,11)

Weigh it out

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

Names and synonyms

1 names

6-Bromo-1H-indazol-4-amine

Work with 4-Amino-6-bromo (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-Bromo-4-iodo-1H-indazole885519-41-559 % similar 6-Bromo-4-fluoro-1H-indazole885520-23-059 % similar 6-Bromoindazole79762-54-252 % similar 1H-Indazol-4-amine41748-71-450 % similar 6-Bromo-4-nitro-1H-indazole885518-46-750 % similar 6-Bromo-4-indazolecarboxylic acid methyl ester885518-49-047 % similar 5-Bromo-1H-indazole53857-57-146 % similar 4-Bromo-6-chloro-1H-indazole885519-03-942 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

6-Bromo-1H-indazol-3-amine404827-77-6 5-Bromo-1H-indazol-3-amine61272-71-7 5-Bromo-1H-benzimidazole-2-amine791595-74-9 5-Bromo-3-methyl-1H-pyrazolo[3,4-b]pyridine885223-65-4 4-Bromo-1H-indazol-3-amine914311-50-5 5-Bromo-1-methyl-1H-benzo[D][1,2,3]triazole944718-31-4

Elsewhere

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