6-fluoro-4-nitro-3H-2-benzofuran-1-one


Chemical Name: 6-fluoro-4-nitro-3H-2-benzofuran-1-one
CAS Number: 1207453-90-4
Product Number: AG00386B(AGN-PC-0BVIFC)
Synonyms:
MDL No:
Molecular Formula: C8H4FNO4
Molecular Weight: 197.1201

Identification/Properties


Computed Properties
Molecular Weight:
197.121g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
197.012g/mol
Monoisotopic Mass:
197.012g/mol
Topological Polar Surface Area:
72.1A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
277
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

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NMR Spectrum


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