2H-1-Benzopyran-2-one, 4-amino-3-nitro-


Chemical Name: 2H-1-Benzopyran-2-one, 4-amino-3-nitro-
CAS Number: 38464-21-0
Product Number: AG00C6WN(AGN-PC-0JKQ0Y)
Synonyms:
MDL No:
Molecular Formula: C9H6N2O4
Molecular Weight: 206.1549

Identification/Properties


Computed Properties
Molecular Weight:
206.157g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
206.033g/mol
Monoisotopic Mass:
206.033g/mol
Topological Polar Surface Area:
98.1A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
345
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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