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Home > Pyridines > 145276-53-5
145276-53-5 | 3(2H)-Pyridazinone, 6-(1-piperazinyl)-
CAS No: 145276-53-5 Catalog No: AG001KR0 MDL No:
Product Description
Catalog Number:
AG001KR0
Chemical Name:
3(2H)-Pyridazinone, 6-(1-piperazinyl)-
CAS Number:
145276-53-5
Molecular Formula:
C8H12N4O
Molecular Weight:
180.2071
IUPAC Name:
3-piperazin-1-yl-1H-pyridazin-6-one
InChI:
InChI=1S/C8H12N4O/c13-8-2-1-7(10-11-8)12-5-3-9-4-6-12/h1-2,9H,3-6H2,(H,11,13)
InChI Key:
YRRIGGVZFKFXEK-UHFFFAOYSA-N
SMILES:
O=c1ccc(n[nH]1)N1CCNCC1
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.101g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
180.211g/mol
Monoisotopic Mass:
180.101g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
56.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.4
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