6-Phenyl-3(2H)-pyridazinone

C10H8N2OCAS 2166-31-6172.19 g/mol

Open in Covalent MOL file
HONN
Phenol

Properties

Molecular formula
C10H8N2O
Molar mass
172.19 g/mol
Exact mass
172.0637 Da
Melting point
151 °C
logP
1.85Crippen estimate
Polar surface area
46.0 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 42 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

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

Identifiers

CAS number
2166-31-6
SMILES
Oc1ccc(-c2ccccc2)nn1
InChIKey
IJUIPRDMWWBTTQ-UHFFFAOYSA-N
InChI
InChI=1S/C10H8N2O/c13-10-7-6-9(11-12-10)8-4-2-1-3-5-8/h1-7H,(H,12,13)

Weigh it out

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

Names and synonyms

10 names
  • 3(2H)-Pyridazinone, 6-phenyl-
  • 3-Pyridazinol, 6-phenyl-
  • 3-Phenyl-6-pyridazone
  • 6-Phenyl-3-pyridazone
  • 3-Phenyl-6-pyridazinone
  • 6-Phenyl-3-pyridazinone
  • 6-Phenylpyridazin-3-ol
  • NSC 13399
  • 6-Phenyl-2H-pyridazin-3-one
  • 3-Phenyl-1H-pyridazin-6-one

Work with 6-Phenyl-3(2H)-pyridazinone

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

Maleic hydrazide123-33-155 % similar 3-Chloro-6-phenylpyridazine20375-65-952 % similar 6-Phenyl-2-thiouracil36822-11-444 % similar 6-Methylpyridazin-3(2H)-one13327-27-041 % similar 2,6-Diphenylpyridine3558-69-841 % similar 2,4,6-Triphenyl-1,3,5-triazine493-77-638 % similar 2-Phenylpyridine1008-89-538 % similar 3(2H)-Pyridazinone504-30-338 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-(1H-Imidazol-1-yl)benzaldehyde10040-98-9 1H-Imidazol-1-ylphenylmethanone10364-94-0 2-(1H-Pyrazol-1-yl)benzaldehyde138479-47-7 1-(2-Quinoxalinyl)ethanone25594-62-1 3-Phenyl-1H-pyrazole-4-carbaldehyde26033-20-5 4-Dicyanomethylene-2,6-dimethyl-4H-pyran28286-88-6 2-Hydroxy-3-phenylpyrazine2882-18-0 5-(Pyridin-2-yl)-2(1H)-pyridone381233-78-9

Elsewhere

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