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Home > Imidazoles > 23671-36-5
23671-36-5 | Pyridine, 2-(1H-imidazol-1-yl)-5-nitro-
CAS No: 23671-36-5 Catalog No: AG002O34 MDL No:MFCD10699022
Product Description
Catalog Number:
AG002O34
Chemical Name:
Pyridine, 2-(1H-imidazol-1-yl)-5-nitro-
CAS Number:
23671-36-5
Molecular Formula:
C8H6N4O2
Molecular Weight:
190.1588
MDL Number:
MFCD10699022
IUPAC Name:
2-imidazol-1-yl-5-nitropyridine
InChI:
InChI=1S/C8H6N4O2/c13-12(14)7-1-2-8(10-5-7)11-4-3-9-6-11/h1-6H
InChI Key:
KHKBELKMRGNELL-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(nc1)n1cncc1
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:
0.8
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