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102766-77-8 | Benzenamine, 4-(5-nitro-2-pyridinyl)-
CAS No: 102766-77-8 Catalog No: AG0008BS MDL No:
Product Description
Catalog Number:
AG0008BS
Chemical Name:
Benzenamine, 4-(5-nitro-2-pyridinyl)-
CAS Number:
102766-77-8
Molecular Formula:
C11H9N3O2
Molecular Weight:
215.2081
IUPAC Name:
4-(5-nitropyridin-2-yl)aniline
InChI:
InChI=1S/C11H9N3O2/c12-9-3-1-8(2-4-9)11-6-5-10(7-13-11)14(15)16/h1-7H,12H2
InChI Key:
DBHIATIGDZLUSE-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)c1ccc(cn1)[N+](=O)[O-]
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.069g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
215.212g/mol
Monoisotopic Mass:
215.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
84.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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