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87769-56-0

87769-56-0 | 4-Pyridazinecarboxamide, 2,3-dihydro-3-oxo-6-phenyl-

CAS No: 87769-56-0 Catalog No: AG004ID4 MDL No:

Product Description

Catalog Number:
AG004ID4
Chemical Name:
4-Pyridazinecarboxamide, 2,3-dihydro-3-oxo-6-phenyl-
CAS Number:
87769-56-0
Molecular Formula:
C11H9N3O2
Molecular Weight:
215.2081
IUPAC Name:
6-oxo-3-phenyl-1H-pyridazine-5-carboxamide
InChI:
InChI=1S/C11H9N3O2/c12-10(15)8-6-9(13-14-11(8)16)7-4-2-1-3-5-7/h1-6H,(H2,12,15)(H,14,16)
InChI Key:
MNHJGWMXKBMNTD-UHFFFAOYSA-N
SMILES:
NC(=O)c1cc(n[nH]c1=O)c1ccccc1

Properties

Complexity:
379  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.069g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
215.212g/mol
Monoisotopic Mass:
215.069g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
84.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  

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