6-(Pyridin-2-yl)pyridazin-3-ol

HCID 4980022CAS 66317-38-2

Substructure search Find similar structures

Basic information

Standard SMILES: O=c1ccc(-c2ccccn2)n[nH]1
InChIKey: DDCLFSUBVBCSFN-UHFFFAOYSA-N
Molecular formula: C9H7N3O
Average molar mass: 173.17 g/mol
Monoisotopic mass: 173.05891184

Names & identifiers

Preferred name: 6-(Pyridin-2-yl)pyridazin-3-ol
IUPAC: 3-pyridin-2-yl-1H-pyridazin-6-one
English name: 3(2H)-Pyridazinone, 6-(2-pyridinyl)-
Molecular formula: C9H7N3O
Molecular weight: 173.17

Names & synonyms

6-(pyridin-2-yl)pyridazin-3-olRefChem:539878853-493-766317-38-26-pyridin-2-ylpyridazin-3-ol6-(pyridin-2-yl)pyridazin-3(2H)-one3-pyridin-2-yl-1H-pyridazin-6-one3(2H)-Pyridazinone, 6-(2-pyridinyl)-6-pyridin-2-yl-2H-pyridazin-3-oneMFCD00114939F1967-03586-(pyridine-2-yl)-2,3-dihydropyridazin-3-one

Show more names

6-(pyridin-2-y)pyridazin-3(2H)-one

6-PYRIDIN-2-YL-3-PYRIDAZINONE6-(pyridin-2-yl)-2H-pyridazin-3-one6-(pyridyl)pyridazin-3-one6-(2-pyridyl)-3-pyridazinolSCHEMBL1456234CHEMBL1834136SCHEMBL13052126SCHEMBL31096513

Database identifiers

CAS: 66317-38-2
PubChem CID: 4980022
DTXSID: DTXSID80407210
ChEMBL: CHEMBL1834136
EC Number: 853-493-7
Nikkaji: J614.221D

Properties

Computed structural properties

XLogP: 0.5
Topological polar surface area: 54.4 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 13
Formal charge: 0
Complexity: 270

Physicochemical properties

storage temp.: Store at Room Tem.
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302
Precautionary statements: 280 · P280-P305+P351+P338

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.