5-Bromo-3-chloro-1H-indazole

C7H4BrClN2CAS 36760-19-7231.48 g/mol

Open in Covalent MOL file
NNHBrCl
Aryl halide

Properties

Molecular formula
C7H4BrClN2
Molar mass
231.48 g/mol
Exact mass
229.9246 Da
logP
2.98Crippen estimate
Polar surface area
28.7 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

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

Precautionary statements

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

Identifiers

CAS number
36760-19-7
SMILES
C1=CC2=NNC(=C2C=C1Br)Cl
InChIKey
SWJXMRPKABLFAG-UHFFFAOYSA-N
InChI
InChI=1S/C7H4BrClN2/c8-4-1-2-6-5(3-4)7(9)11-10-6/h1-3H,(H,10,11)

Weigh it out

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Work with 5-Bromo-3-chloro-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

5-Bromo-3-iodo (1H)indazole459133-66-561 % similar 5-Bromo-3-methyl-1H-indazole552331-16-561 % similar 6-Bromo-2,4-dichloroquinazoline102393-82-847 % similar 6-Bromo-4-chloro-quinazoline38267-96-847 % similar 6-Bromo-4-chloroquinoline65340-70-747 % similar 6-Bromo-3-methyl-1H-indazole7746-27-247 % similar 3-Chloro-2H-indazol-6-amine21413-23-044 % similar 6-Bromo-1H-indazole-3-carbaldehyde885271-72-744 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Bromo-4-chloro-1H-pyrrolo[2,3-b]pyridine1000340-39-5 5-Bromo-4-chloro-1H-indazole1082041-90-4 5-Bromo-7-chloro-1H-indazole635712-44-6 5-Bromo-4-chloro-1H-pyrrolo[2,3-b]pyridine876343-82-7 4-Bromo-6-chloro-1H-indazole885519-03-9 6-Chloro-3-bromo-imidazo[1,2-A]pyridine886371-28-4 4-Bromo-6-chloro-1H-pyrrolo[2,3-b]pyridine942920-50-5

Elsewhere

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