Acetic acid, [(2-oxo-2H-1-benzopyran-7-yl)oxy]-


Chemical Name: Acetic acid, [(2-oxo-2H-1-benzopyran-7-yl)oxy]-
CAS Number: 126424-85-9
Product Number: AG000SSU(AGN-PC-0JXEM4)
Synonyms:
MDL No:
Molecular Formula: C11H8O5
Molecular Weight: 220.1782

Identification/Properties


Computed Properties
Molecular Weight:
220.18g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
220.037g/mol
Monoisotopic Mass:
220.037g/mol
Topological Polar Surface Area:
72.8A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
322
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


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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