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Home > Nitro Compounds > 26002-58-4
26002-58-4 | Benzamide, 3,6-dimethoxy-2-nitro-
CAS No: 26002-58-4 Catalog No: AG002RD8 MDL No:
Product Description
Catalog Number:
AG002RD8
Chemical Name:
Benzamide, 3,6-dimethoxy-2-nitro-
CAS Number:
26002-58-4
Molecular Formula:
C9H10N2O5
Molecular Weight:
226.1861
IUPAC Name:
3,6-dimethoxy-2-nitrobenzamide
InChI:
InChI=1S/C9H10N2O5/c1-15-5-3-4-6(16-2)8(11(13)14)7(5)9(10)12/h3-4H,1-2H3,(H2,10,12)
InChI Key:
IIVVGIHHLJDOIE-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1[N+](=O)[O-])C(=O)N)OC
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.059g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
226.188g/mol
Monoisotopic Mass:
226.059g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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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