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Home > Pyridines > 2059941-42-1
2059941-42-1 | 6-(pyridin-3-yl)-2,3-dihydropyridazin-3-one hydrochloride
CAS No: 2059941-42-1 Catalog No: AG01BXNN MDL No:MFCD30497698
Product Description
Catalog Number:
AG01BXNN
Chemical Name:
6-(pyridin-3-yl)-2,3-dihydropyridazin-3-one hydrochloride
CAS Number:
2059941-42-1
Molecular Formula:
C9H8ClN3O
Molecular Weight:
209.6323
MDL Number:
MFCD30497698
IUPAC Name:
3-pyridin-3-yl-1H-pyridazin-6-one;hydrochloride
InChI:
InChI=1S/C9H7N3O.ClH/c13-9-4-3-8(11-12-9)7-2-1-5-10-6-7;/h1-6H,(H,12,13);1H
InChI Key:
DRXYPRVMTOPRIE-UHFFFAOYSA-N
SMILES:
O=c1ccc(n[nH]1)c1cccnc1.Cl
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.036g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
209.633g/mol
Monoisotopic Mass:
209.036g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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