2-Benzofurancarboxylic acid, 5-nitro-


Chemical Name: 2-Benzofurancarboxylic acid, 5-nitro-
CAS Number: 10242-12-3
Product Number: AG0007FE(AGN-PC-0K5RID)
Synonyms:
MDL No:
Molecular Formula: C9H5NO5
Molecular Weight: 207.1397

Identification/Properties


Computed Properties
Molecular Weight:
207.141g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
207.017g/mol
Monoisotopic Mass:
207.017g/mol
Topological Polar Surface Area:
96.3A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
287
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H319
Precautionary Statements:
P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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