4H-1-Benzopyran-3-carboxylic acid, 6-methyl-4-oxo-


Chemical Name: 4H-1-Benzopyran-3-carboxylic acid, 6-methyl-4-oxo-
CAS Number: 68723-78-4
Product Number: AG0061QN(AGN-PC-0KKNIJ)
Synonyms:
MDL No: MFCD02683790
Molecular Formula: C11H8O4
Molecular Weight: 204.1788

Identification/Properties


Computed Properties
Molecular Weight:
204.181g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
204.042g/mol
Monoisotopic Mass:
204.042g/mol
Topological Polar Surface Area:
63.6A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
332
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


NMR Spectrum


Other Analytical Data


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