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Home > Nitro Compounds > 723738-42-9
723738-42-9 | N-[3-(benzyloxy)pyridin-2-yl]-4-nitrobenzamide
CAS No: 723738-42-9 Catalog No: AG00ITK4 MDL No:MFCD03002026
Product Description
Catalog Number:
AG00ITK4
Chemical Name:
N-[3-(benzyloxy)pyridin-2-yl]-4-nitrobenzamide
CAS Number:
723738-42-9
Molecular Formula:
C19H15N3O4
Molecular Weight:
349.3401
MDL Number:
MFCD03002026
IUPAC Name:
4-nitro-N-(3-phenylmethoxypyridin-2-yl)benzamide
InChI:
InChI=1S/C19H15N3O4/c23-19(15-8-10-16(11-9-15)22(24)25)21-18-17(7-4-12-20-18)26-13-14-5-2-1-3-6-14/h1-12H,13H2,(H,20,21,23)
InChI Key:
LJMZUGXZJVFKMC-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)[N+](=O)[O-])Nc1ncccc1OCc1ccccc1
Properties
Complexity:
468
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.106g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
349.346g/mol
Monoisotopic Mass:
349.106g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
97A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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