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Home > Nitro Compounds > 123792-62-1
123792-62-1 | Pyridine, 3-nitro-5-phenyl-
CAS No: 123792-62-1 Catalog No: AG000L2X MDL No:
Product Description
Catalog Number:
AG000L2X
Chemical Name:
Pyridine, 3-nitro-5-phenyl-
CAS Number:
123792-62-1
Molecular Formula:
C11H8N2O2
Molecular Weight:
200.1934
IUPAC Name:
3-nitro-5-phenylpyridine
InChI:
InChI=1S/C11H8N2O2/c14-13(15)11-6-10(7-12-8-11)9-4-2-1-3-5-9/h1-8H
InChI Key:
LXBLPKWPBMJMOW-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cncc(c1)c1ccccc1
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.059g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.197g/mol
Monoisotopic Mass:
200.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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