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Home > Nitro Compounds > 5375-23-5
5375-23-5 | 8-Methyl-5-nitrocinnolin-4(1H)-one
CAS No: 5375-23-5 Catalog No: AG01EBUU MDL No:
Product Description
Catalog Number:
AG01EBUU
Chemical Name:
8-Methyl-5-nitrocinnolin-4(1H)-one
CAS Number:
5375-23-5
IUPAC Name:
8-methyl-5-nitro-1H-cinnolin-4-one
InChI:
InChI=1S/C9H7N3O3/c1-5-2-3-6(12(14)15)8-7(13)4-10-11-9(5)8/h2-4H,1H3,(H,11,13)
InChI Key:
JIEGKBBUOXKQDF-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:
205.049g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
205.173g/mol
Monoisotopic Mass:
205.049g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
87.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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