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Home > Imidazoles > 137986-62-0
137986-62-0 | Pyridine, 2-(4-nitro-1H-imidazol-1-yl)-
CAS No: 137986-62-0 Catalog No: AG0017RU MDL No:
Product Description
Catalog Number:
AG0017RU
Chemical Name:
Pyridine, 2-(4-nitro-1H-imidazol-1-yl)-
CAS Number:
137986-62-0
Molecular Formula:
C8H6N4O2
Molecular Weight:
190.1588
IUPAC Name:
2-(4-nitroimidazol-1-yl)pyridine
InChI:
InChI=1S/C8H6N4O2/c13-12(14)8-5-11(6-10-8)7-3-1-2-4-9-7/h1-6H
InChI Key:
SEEOXNSNJDOPHM-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ncn(c1)c1ccccn1
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.049g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.162g/mol
Monoisotopic Mass:
190.049g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
76.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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