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16077-23-9 | 4-Cinnolinamine, N-methyl-6-nitro-
CAS No: 16077-23-9 Catalog No: AG001VBK MDL No:
Product Description
Catalog Number:
AG001VBK
Chemical Name:
4-Cinnolinamine, N-methyl-6-nitro-
CAS Number:
16077-23-9
Molecular Formula:
C9H8N4O2
Molecular Weight:
204.1854
IUPAC Name:
N-methyl-6-nitrocinnolin-4-amine
InChI:
InChI=1S/C9H8N4O2/c1-10-9-5-11-12-8-3-2-6(13(14)15)4-7(8)9/h2-5H,1H3,(H,10,12)
InChI Key:
VHDFDJDAJKKJBA-UHFFFAOYSA-N
SMILES:
CNc1cnnc2c1cc(cc2)[N+](=O)[O-]
Properties
Complexity:
243
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.065g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.189g/mol
Monoisotopic Mass:
204.065g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
83.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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