chempirical

7-Bromo-1H-indazole

C7H5BrN2CAS 53857-58-2197.03 g/mol

Open in Covalent MOL file
BrHNN
Aryl halide

Properties

Molecular formula
C7H5BrN2
Molar mass
197.03 g/mol
Exact mass
195.9636 Da
logP
2.33Crippen estimate
Polar surface area
28.7 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
53857-58-2
SMILES
Brc1cccc2c[nH]nc12
InChIKey
KMHHWCPTROQUFM-UHFFFAOYSA-N
InChI
InChI=1S/C7H5BrN2/c8-6-3-1-2-5-4-9-10-7(5)6/h1-4H,(H,9,10)

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Names and synonyms

2 names
  • 1H-Indazole, 7-bromo-
  • 7-Bromoindazole

Work with 7-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

1H-Indazol-7-amine21443-96-957 % similar 7-Nitroindazole2942-42-947 % similar 8-Bromoquinoline16567-18-347 % similar 8-Bromo-2-chloroquinazoline956100-63-341 % similar 7-Bromo-3-methyl-1H-indazole1159511-75-740 % similar 4-Bromo-3-methyl-1H-pyrazole13808-64-539 % similar 2,3-Dibromonaphthalene13214-70-536 % similar 4-Bromo-3-(trifluoromethyl)-1H-pyrazole19968-17-335 % similar

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

Same formula

5-Bromo-4-azaindole1000341-51-4 2-Bromo-5-cyano-4-picoline1003711-35-0 5-Bromopyrazolo[1,5-A]pyridine1060812-84-1 2-Amino-3-bromobenzonitrile114344-60-4 5-Bromo-1H-pyrrolo[2,3-c]pyridine1215387-58-8 6-Bromopyrazolo[1,5-A]pyridine1264193-11-4 6-Bromo-1H-pyrrolo[2,3-B]pyridine143468-13-7 5-Bromo-3-methylpyridine-2-carbonitrile156072-86-5

Elsewhere

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