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88220-68-2

88220-68-2 | 2-Benzofurancarboxamide, 6-hydroxy-7-nitro-

CAS No: 88220-68-2 Catalog No: AG004DF7 MDL No:

Product Description

Catalog Number:
AG004DF7
Chemical Name:
2-Benzofurancarboxamide, 6-hydroxy-7-nitro-
CAS Number:
88220-68-2
Molecular Formula:
C9H6N2O5
Molecular Weight:
222.1543
IUPAC Name:
6-hydroxy-7-nitro-1-benzofuran-2-carboxamide
InChI:
InChI=1S/C9H6N2O5/c10-9(13)6-3-4-1-2-5(12)7(11(14)15)8(4)16-6/h1-3,12H,(H2,10,13)
InChI Key:
IGCXHQXIRYUUHT-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(O)ccc2c1oc(c2)C(=O)N

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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