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Home > Nitro Compounds > 88220-67-1
88220-67-1 | 2-Benzofurancarboxamide, 6-hydroxy-5-nitro-
CAS No: 88220-67-1 Catalog No: AG004BAM MDL No:
Product Description
Catalog Number:
AG004BAM
Chemical Name:
2-Benzofurancarboxamide, 6-hydroxy-5-nitro-
CAS Number:
88220-67-1
Molecular Formula:
C9H6N2O5
Molecular Weight:
222.1543
IUPAC Name:
6-hydroxy-5-nitro-1-benzofuran-2-carboxamide
InChI:
InChI=1S/C9H6N2O5/c10-9(13)8-2-4-1-5(11(14)15)6(12)3-7(4)16-8/h1-3,12H,(H2,10,13)
InChI Key:
CQWLJFMMHBTYSW-UHFFFAOYSA-N
SMILES:
NC(=O)c1cc2c(o1)cc(c(c2)[N+](=O)[O-])O
Properties
Complexity:
316
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.028g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
222.156g/mol
Monoisotopic Mass:
222.028g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
122A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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