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13817-74-8 | 3,6-Pyridazinedione, 1,2-dihydro-1-methyl-2-phenyl-
CAS No: 13817-74-8 Catalog No: AG00184C MDL No:
Product Description
Catalog Number:
AG00184C
Chemical Name:
3,6-Pyridazinedione, 1,2-dihydro-1-methyl-2-phenyl-
CAS Number:
13817-74-8
Molecular Formula:
C11H10N2O2
Molecular Weight:
202.2093
IUPAC Name:
1-methyl-2-phenylpyridazine-3,6-dione
InChI:
InChI=1S/C11H10N2O2/c1-12-10(14)7-8-11(15)13(12)9-5-3-2-4-6-9/h2-8H,1H3
InChI Key:
HJHFNYLISJKDGC-UHFFFAOYSA-N
SMILES:
O=c1ccc(=O)n(n1c1ccccc1)C
NSC Number:
93782
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.074g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.213g/mol
Monoisotopic Mass:
202.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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