3-Bromoimidazo(1,2-b)pyridazine

C₆H₄BrN₃CAS 18087-73-5198.02 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₄BrN₃
Molar mass: 198.02 g/mol
Exact mass: 196.9589 Da
logP: 1.49Crippen estimate
Polar surface area: 30.2 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 0

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation50% of notifiers
H335 May cause respiratory irritation50% of notifiers

Aggregated from 2 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

18087-73-5

SMILES

Brc1cnc2cccnn12

InChIKey

KJQVHOFAWISYDO-UHFFFAOYSA-N

InChI

InChI=1S/C6H4BrN3/c7-5-4-8-6-2-1-3-9-10(5)6/h1-4H

Weigh it out

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

Names and synonyms

2 names

3-Bromoimidazo[1,2-B]pyridazine
Imidazo[1,2-b]pyridazine, 3-bromo-

Work with 3-Bromoimidazo(1,2-b)pyridazine

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

3-Ethynylimidazo[1,2-b]pyridazine943320-61-450 % similar 3-Bromo-6-chloroimidazo(1,2-b)pyridazine13526-66-448 % similar 3-Bromoimidazo[1,2-A]pyridine4926-47-047 % similar 5-Bromo-imidazo[1,2-A]pyridine69214-09-142 % similar Imidazo(1,2-b)pyridazine766-55-241 % similar 3-Bromoimidazo(1,2-a)pyrazine57948-41-138 % similar 7-Chloropyrazolo[1,5-A]pyrimidine58347-49-238 % similar 3-Bromo-N-propylimidazo[1,2-B]pyridazin-6-amine1034621-79-838 % similar

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

Same formula

4-Bromo-1H-pyrazolo[3,4-C]pyridine1032943-43-3 7-Bromo-(1,2,4)triazolo(1,5-a)pyridine1053655-66-5 6-Bromo-[1,2,4]triazolo[4,3-a]pyridine108281-79-4 6-Bromo-1H-pyrazolo[4,3-b]pyridine1150617-54-1 6-Bromoimidazo[1,2-B]pyridazine1159977-65-7 6-Bromo-1H-pyrazolo[4,3-c]pyridine1206973-12-7 5-Bromo-(1,2,4)triazolo(1,5-a)pyridine143329-58-2 5-Bromo-7H-pyrrolo[2,3-D]pyrimidine175791-49-8

Elsewhere

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