4-(6-(Trifluoromethyl)pyridazin-3-yl)pyridin-2(1H)-one

HCID 57950262
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Basic information

CAS
1173155-66-2
Standard SMILES
O=c1cc(-c2ccc(C(F)(F)F)nn2)cc[nH]1
InChIKey
XCPLJSUPZPYXCF-UHFFFAOYSA-N
Molecular formula
C10H6F3N3O
Average molar mass
241.17 g/mol
Monoisotopic mass
241.04629631

Names & identifiers

Preferred name
4-(6-(Trifluoromethyl)pyridazin-3-yl)pyridin-2(1H)-one
IUPAC
4-[6-(trifluoromethyl)pyridazin-3-yl]-1H-pyridin-2-one

Names & synonyms

4-(6-(Trifluoromethyl)pyridazin-3-yl)pyridin-2(1H)-one4-[6-(Trifluoromethyl)pyridazin-3-yl]pyridin-2(1H)-oneSCHEMBL155632SCHEMBL13787286DTXSID2012117671173155-66-24-[6-(Trifluoromethyl)-3-pyridazinyl]-2(1H)-pyridinone

Database identifiers

CAS
1173155-66-2
PubChem CID
57950262
DTXSID
DTXSID201211767

Properties

Computed structural properties

XLogP
0.3
Topological polar surface area
54.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
1
Heavy atoms
17

Related reactions

11 records
New reaction record

Compound notes

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