Ethyl 6-chloroimidazo[1,2-b]pyridazine-2-carboxylate

C₉H₈ClN₃O₂CAS 64067-99-8225.63 g/mol

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Aryl halide Ester

Properties

Molecular formula: C₉H₈ClN₃O₂
Molar mass: 225.63 g/mol
Exact mass: 225.0305 Da
Melting point: 159–161 °C
logP: 1.56Crippen estimate
Polar surface area: 56.5 Å²
H-bond donors / acceptors: 0 / 4
Rotatable bonds: 2

Identifiers

CAS number

64067-99-8

SMILES

CCOC(=O)c1cn2nc(Cl)ccc2n1

InChIKey

AZEPEWATPYRPBM-UHFFFAOYSA-N

InChI

InChI=1S/C9H8ClN3O2/c1-2-15-9(14)6-5-13-8(11-6)4-3-7(10)12-13/h3-5H,2H2,1H3

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Names and synonyms

2 names

Imidazo[1,2-B]pyridazine-2-carboxylic acid, 6-chloro-, ethyl ester
6-Chloroimidazo[1,2-b]pyridazine-2-carboxylic acid ethyl ester

Work with Ethyl 6-chloroimidazo[1,2-b]pyridazine-2-carboxylate

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

Ethyl 6-chloro-3-pyridazinecarboxylate75680-92-156 % similar 6-Bromoimidazo[1,2-A]pyridine-2-carboxylic acid ethyl ester67625-37-054 % similar Diethyl 2,6-pyridinedicarboxylate15658-60-351 % similar Ethyl 6-chloronicotinate49608-01-751 % similar Ethyl 5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-2-carboxylate91476-82-343 % similar 2-Chloro-5-(ethoxycarbonyl)pyrimidine89793-12-443 % similar Ethyl 2-pyridinecarboxylate2524-52-942 % similar Ethyl 2,4-dichloro-5-pyrimidinecarboxylate51940-64-841 % similar

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

Same formula

Ethyl 6-chloroimidazo[1,2-b]pyridazine-3-carboxylate1150566-27-0 Ethyl 5-chloropyrazolo(1,5-a)pyrimidine-3-carboxylate1224944-77-7 Ethyl 4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate144927-57-1

Elsewhere

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