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Home > Nitro Compounds > 160856-97-3
160856-97-3 | Benzamide, N-(5-methyl-3-isoxazolyl)-3-nitro-
CAS No: 160856-97-3 Catalog No: AG001VEO MDL No:
Product Description
Catalog Number:
AG001VEO
Chemical Name:
Benzamide, N-(5-methyl-3-isoxazolyl)-3-nitro-
CAS Number:
160856-97-3
Molecular Formula:
C11H9N3O4
Molecular Weight:
247.2069
IUPAC Name:
N-(5-methyl-1,2-oxazol-3-yl)-3-nitrobenzamide
InChI:
InChI=1S/C11H9N3O4/c1-7-5-10(13-18-7)12-11(15)8-3-2-4-9(6-8)14(16)17/h2-6H,1H3,(H,12,13,15)
InChI Key:
ZUBXSIDFUNTNSP-UHFFFAOYSA-N
SMILES:
Cc1onc(c1)NC(=O)c1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.059g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
247.21g/mol
Monoisotopic Mass:
247.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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