chempirical

1H-Indazole-3-carbaldehyde

C8H6N2OCAS 5235-10-9146.15 g/mol

Open in Covalent MOL file
NHNO
Aldehyde

Properties

Molecular formula
C8H6N2O
Molar mass
146.15 g/mol
Exact mass
146.0480 Da
logP
1.38Crippen estimate
Polar surface area
45.8 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Hazards

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

Identifiers

CAS number
5235-10-9
SMILES
C1=CC2=C(NN=C2C=C1)C=O
InChIKey
VXOSGHMXAYBBBB-UHFFFAOYSA-N
InChI
InChI=1S/C8H6N2O/c11-5-8-6-3-1-2-4-7(6)9-10-8/h1-5H,(H,9,10)

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Names and synonyms

1 names
  • Indazole-3-carbaldehyde

Work with 1H-Indazole-3-carbaldehyde

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

6-Bromo-1H-indazole-3-carbaldehyde885271-72-757 % similar 3-Methyl-1H-indazole3176-62-347 % similar 3-Iodo-1H-indazole66607-27-047 % similar 4-Quinolinecarboxaldehyde4363-93-343 % similar 3-(Hydroxymethyl)indazole64132-13-443 % similar 9,10-Anthracenedicarboxaldehyde7044-91-941 % similar 1H-Benzimidazole-2-carboxaldehyde3314-30-539 % similar Quinoline-5-carboxaldehyde22934-41-438 % similar

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

Same formula

Imidazo[1,2-A]pyridine-6-carbaldehyde116355-16-9 Imidazo(1,2-a)pyridine-2-carbaldehyde118000-43-4 1(2H)-Phthalazinone119-39-1 2(1H)-Quinoxalinone1196-57-2 2-Cyanobenzamide17174-98-0 1H-Indazole-5-carboxaldehyde253801-04-6 1H-Pyrrolo(2,3-c)pyridine-3-carbaldehyde25957-65-7 1H-Pyrrolo[3,2-B]pyridine-3-carboxaldehyde (9ci)276862-85-2

Elsewhere

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