chempirical

6-Chloroimidazo[1,2-B]pyridazine-2-carboxylic acid

C7H4ClN3O2CAS 14714-24-0197.58 g/mol

Open in Covalent MOL file
NNNOHOCl
Aryl halideCarboxylic acid

Properties

Molecular formula
C7H4ClN3O2
Molar mass
197.58 g/mol
Exact mass
196.9992 Da
logP
1.08Crippen estimate
Polar surface area
67.5 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Identifiers

CAS number
14714-24-0
SMILES
C1=CC(=NN2C1=NC(=C2)C(=O)O)Cl
InChIKey
HTUZJYQXKFDVLT-UHFFFAOYSA-N
InChI
InChI=1S/C7H4ClN3O2/c8-5-1-2-6-9-4(7(12)13)3-11(6)10-5/h1-3H,(H,12,13)

Weigh it out

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

Work with 6-Chloroimidazo[1,2-B]pyridazine-2-carboxylic acid

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-chloroimidazo[1,2-b]pyridazine-2-carboxylate64067-99-857 % similar 6-Chloropicolinic acid4684-94-053 % similar 6-Chloro-3-pyridazinecarboxylic acid5096-73-149 % similar Imidazo[1,2-A]pyridine-2-carboxylic acid64951-08-247 % similar 5-Chloro-2-pyrazinecarboxylic acid36070-80-145 % similar 6-Chloronicotinic acid5326-23-844 % similar Dipicolinic acid499-83-243 % similar Clopyralid1702-17-643 % similar

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

Same formula

6-Chloro-5-nitro-1H-indazole101420-98-8 4-Chloro-7H-pyrrolo[2,3-D]pyrimidine-6-carboxylic acid1016241-80-7 2-Amino-3-chloro-5-nitrobenzonitrile20352-84-5

Elsewhere

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