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25506-06-3 | 4-Phenylisoxazolo[3,4-d]pyridazin-7(6H)-one
CAS No: 25506-06-3 Catalog No: AG00CDAP MDL No:
Product Description
Catalog Number:
AG00CDAP
Chemical Name:
4-Phenylisoxazolo[3,4-d]pyridazin-7(6H)-one
CAS Number:
25506-06-3
IUPAC Name:
4-phenyl-6H-[1,2]oxazolo[3,4-d]pyridazin-7-one
InChI:
InChI=1S/C11H7N3O2/c15-11-10-8(6-16-14-10)9(12-13-11)7-4-2-1-3-5-7/h1-6H,(H,13,15)
InChI Key:
GXRAZEHWDPPKRU-UHFFFAOYSA-N
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.054g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
213.196g/mol
Monoisotopic Mass:
213.054g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
67.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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