3-Ethynylimidazo[1,2-b]pyridazine

C8H5N3CAS 943320-61-4143.15 g/mol

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NNN
Alkyne

Properties

Molecular formula
C8H5N3
Molar mass
143.15 g/mol
Exact mass
143.0483 Da
logP
0.71Crippen estimate
Polar surface area
30.2 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
943320-61-4
SMILES
C#Cc1cnc2cccnn12
InChIKey
VYOHSFQVMLAURO-UHFFFAOYSA-N
InChI
InChI=1S/C8H5N3/c1-2-7-6-9-8-4-3-5-10-11(7)8/h1,3-6H

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Names and synonyms

2 names
  • Imidazo[1,2-b]pyridazine, 3-ethynyl-
  • 3-Ethynylimidazolo[1,2-b]pyridazine

Work with 3-Ethynylimidazo[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-Bromoimidazo(1,2-b)pyridazine18087-73-550 % similar 3-Ethynylpyridine2510-23-837 % similar Imidazo(1,2-b)pyridazine766-55-237 % similar 2-Ethynylpyridine1945-84-234 % similar 7-Chloropyrazolo[1,5-A]pyrimidine58347-49-232 % similar 5-Bromo-(1,2,4)triazolo(1,5-a)pyridine143329-58-231 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1H-Pyrrolo[3,2-b]pyridine-5-carbonitrile146767-63-7 1H-Pyrrolo[2,3-b]pyridine-6-carbonitrile189882-33-5 1H-Pyrrolo(2,3-b)pyridine-4-carbonitrile344327-11-3 7-Azaindole-3-carbonitrile4414-89-5 1H-Indazole-3-carbonitrile50264-88-5 1H-Pyrrolo(2,3-b)pyridine-5-carbonitrile517918-95-5 4-Amino-1,2-benzenedicarbonitrile56765-79-8 1H-Indazole-5-carbonitrile74626-47-4

Elsewhere

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