1H-Indazole-4-carboxaldehyde

C8H6N2OCAS 669050-70-8146.15 g/mol

Open in Covalent MOL file
ONHN
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

Warning
Irritant (GHS07)

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
669050-70-8
SMILES
O=Cc1cccc2[nH]ncc12
InChIKey
FPJXNCKSPFGQGC-UHFFFAOYSA-N
InChI
InChI=1S/C8H6N2O/c11-5-6-2-1-3-8-7(6)4-9-10-8/h1-5H,(H,9,10)

Weigh it out

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Names and synonyms

2 names
  • 1H-Indazole-4-carbaldehyde
  • 2H-Indazole-4-carbaldehyde

Work with 1H-Indazole-4-carboxaldehyde

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

Indole-4-carboxaldehyde1074-86-853 % similar 4-Chloro (1H)indazole13096-96-352 % similar 4-Bromo (1H)indazole186407-74-952 % similar 4-Fluoroindazole341-23-150 % similar 1H-Indazol-4-amine41748-71-450 % similar 1H-Indazol-4-ol81382-45-850 % similar 1H-Indazole-4-carboxylic acid677306-38-646 % similar 3-Phenyl-1H-pyrazole-4-carbaldehyde26033-20-546 % 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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