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3537-09-5 | 6-NITRO-3H-IMIDAZO[4,5-B]PYRIDINE
CAS No: 3537-09-5 Catalog No: AG00CM1D MDL No:MFCD11215559
Product Description
Catalog Number:
AG00CM1D
Chemical Name:
6-NITRO-3H-IMIDAZO[4,5-B]PYRIDINE
CAS Number:
3537-09-5
Molecular Formula:
C6H4N4O2
Molecular Weight:
164.1216
MDL Number:
MFCD11215559
IUPAC Name:
6-nitro-1H-imidazo[4,5-b]pyridine
InChI:
InChI=1S/C6H4N4O2/c11-10(12)4-1-5-6(7-2-4)9-3-8-5/h1-3H,(H,7,8,9)
InChI Key:
NYSTWXCATZYTAU-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc2nc[nH]c2nc1
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.033g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
164.124g/mol
Monoisotopic Mass:
164.033g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
87.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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