2H-1-Benzopyran-3-carboxylic acid, 7-hydroxy-2-oxo-, ethyl ester


Chemical Name: 2H-1-Benzopyran-3-carboxylic acid, 7-hydroxy-2-oxo-, ethyl ester
CAS Number: 6093-71-6
Product Number: AG00E9S6(AGN-PC-0LPM4Q)
Synonyms:
MDL No:
Molecular Formula: C12H10O5
Molecular Weight: 234.2048

Identification/Properties


Computed Properties
Molecular Weight:
234.207g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
234.053g/mol
Monoisotopic Mass:
234.053g/mol
Topological Polar Surface Area:
72.8A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
360
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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