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Home > Nitro Compounds > 59656-62-1
59656-62-1 | 2-nitro-4-(pyridin-4-yl)aniline
CAS No: 59656-62-1 Catalog No: AG01AM3O MDL No:MFCD27926068
Product Description
Catalog Number:
AG01AM3O
Chemical Name:
2-nitro-4-(pyridin-4-yl)aniline
CAS Number:
59656-62-1
Molecular Formula:
C11H9N3O2
Molecular Weight:
215.2081
MDL Number:
MFCD27926068
IUPAC Name:
2-nitro-4-pyridin-4-ylaniline
InChI:
InChI=1S/C11H9N3O2/c12-10-2-1-9(7-11(10)14(15)16)8-3-5-13-6-4-8/h1-7H,12H2
InChI Key:
JJIIMBRBDKEWEV-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1N)c1ccncc1
Properties
Complexity:
248
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:
2.2
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