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Home > Nitro Compounds > 88220-51-3
88220-51-3 | 2-Benzofurancarboxamide, 5-methoxy-6-nitro-
CAS No: 88220-51-3 Catalog No: AG004BOP MDL No:
Product Description
Catalog Number:
AG004BOP
Chemical Name:
2-Benzofurancarboxamide, 5-methoxy-6-nitro-
CAS Number:
88220-51-3
Molecular Formula:
C10H8N2O5
Molecular Weight:
236.1809
IUPAC Name:
5-methoxy-6-nitro-1-benzofuran-2-carboxamide
InChI:
InChI=1S/C10H8N2O5/c1-16-8-2-5-3-9(10(11)13)17-7(5)4-6(8)12(14)15/h2-4H,1H3,(H2,11,13)
InChI Key:
UOOJPLHIBZFAEC-UHFFFAOYSA-N
SMILES:
COc1cc2cc(oc2cc1[N+](=O)[O-])C(=O)N
Properties
Complexity:
329
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.043g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
236.183g/mol
Monoisotopic Mass:
236.043g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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