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30481-54-0 | Benzamide, 2-amino-5-nitro-N-phenyl-
CAS No: 30481-54-0 Catalog No: AG003099 MDL No:MFCD00017038
Product Description
Catalog Number:
AG003099
Chemical Name:
Benzamide, 2-amino-5-nitro-N-phenyl-
CAS Number:
30481-54-0
Molecular Formula:
C13H11N3O3
Molecular Weight:
257.2447
MDL Number:
MFCD00017038
IUPAC Name:
2-amino-5-nitro-N-phenylbenzamide
InChI:
InChI=1S/C13H11N3O3/c14-12-7-6-10(16(18)19)8-11(12)13(17)15-9-4-2-1-3-5-9/h1-8H,14H2,(H,15,17)
InChI Key:
INKGKPCLQCFQKB-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1C(=O)Nc1ccccc1)[N+](=O)[O-]
Properties
Complexity:
337
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.08g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
257.249g/mol
Monoisotopic Mass:
257.08g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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