chempirical

6-Bromo-3-iodo-1H-indazole

C7H4BrIN2CAS 885521-88-0322.93 g/mol

Open in Covalent MOL file
BrINNH
Aryl halide

Properties

Molecular formula
C7H4BrIN2
Molar mass
322.93 g/mol
Exact mass
321.8603 Da
logP
2.93Crippen estimate
Polar surface area
28.7 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
885521-88-0
SMILES
Brc1ccc2c(I)n[nH]c2c1
InChIKey
POXUFQBYDQCUFO-UHFFFAOYSA-N
InChI
InChI=1S/C7H4BrIN2/c8-4-1-2-5-6(3-4)10-11-7(5)9/h1-3H,(H,10,11)

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

Names and synonyms

2 names
  • 1H-Indazole, 6-bromo-3-iodo-
  • 6-Bromo-3-iodoindazole

Work with 6-Bromo-3-iodo-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-1H-indazole-3-carbonitrile885278-24-056 % similar 2-Bromocarbazole3652-90-242 % similar 5-Bromo-1H-indazole-3-carboxylic acid1077-94-740 % similar 3-Iodo-5-nitro-1H-indazole70315-69-440 % similar 5-Bromo-3-methyl-1H-indazole552331-16-538 % similar 7-Bromo-4-hydroxyquinoline82121-06-038 % similar 6-Bromo-4-fluoro-1H-indazole885520-23-038 % similar 5-Bromo-3-iodo-1H-pyrazolo[3,4-B]pyridine875781-18-338 % similar

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

Same formula

6-Bromo-4-iodo-1H-indazole885519-41-5

Elsewhere

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