2H-1-Benzopyran-3-acetic acid, 7-amino-4-methyl-2-oxo-


Chemical Name: 2H-1-Benzopyran-3-acetic acid, 7-amino-4-methyl-2-oxo-
CAS Number: 106562-32-7
Product Number: AG0038BU(AGN-PC-0JMLQ0)
Synonyms:
MDL No:
Molecular Formula: C12H11NO4
Molecular Weight: 233.2200

Identification/Properties


Computed Properties
Molecular Weight:
233.223g/mol
XLogP3:
0.6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
233.069g/mol
Monoisotopic Mass:
233.069g/mol
Topological Polar Surface Area:
89.6A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
388
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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