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Home > Nitro Compounds > 574721-48-5
574721-48-5 | 3-Methoxy-N-(5-nitro-pyridin-2-yl)-benzamide
CAS No: 574721-48-5 Catalog No: AG01EWIA MDL No:
Product Description
Catalog Number:
AG01EWIA
Chemical Name:
3-Methoxy-N-(5-nitro-pyridin-2-yl)-benzamide
CAS Number:
574721-48-5
Molecular Formula:
C13H11N3O4
Molecular Weight:
273.2441
IUPAC Name:
3-methoxy-N-(5-nitropyridin-2-yl)benzamide
InChI:
InChI=1S/C13H11N3O4/c1-20-11-4-2-3-9(7-11)13(17)15-12-6-5-10(8-14-12)16(18)19/h2-8H,1H3,(H,14,15,17)
InChI Key:
WNMCFZMDPBTXPM-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)C(=O)Nc1ccc(cn1)[N+](=O)[O-]
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.075g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
273.248g/mol
Monoisotopic Mass:
273.075g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
97A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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