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Home > Pyridines > 361979-27-3
361979-27-3 | 5-ethyl-6-phenyl-2,3-dihydropyridazin-3-one
CAS No: 361979-27-3 Catalog No: AG01C2WD MDL No:MFCD16871339
Product Description
Catalog Number:
AG01C2WD
Chemical Name:
5-ethyl-6-phenyl-2,3-dihydropyridazin-3-one
CAS Number:
361979-27-3
Molecular Formula:
C12H12N2O
Molecular Weight:
200.2365
MDL Number:
MFCD16871339
IUPAC Name:
4-ethyl-3-phenyl-1H-pyridazin-6-one
InChI:
InChI=1S/C12H12N2O/c1-2-9-8-11(15)13-14-12(9)10-6-4-3-5-7-10/h3-8H,2H2,1H3,(H,13,15)
InChI Key:
GQBIHHHKZBNQBN-UHFFFAOYSA-N
SMILES:
CCc1cc(=O)[nH]nc1c1ccccc1
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.095g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
200.241g/mol
Monoisotopic Mass:
200.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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