2H-1-Benzopyran-2-one, 6,7-dihydroxy-


Chemical Name: 2H-1-Benzopyran-2-one, 6,7-dihydroxy-
CAS Number: 305-01-1
Product Number: AG0030E0(AGN-PC-0LPKEE)
Synonyms:
MDL No:
Molecular Formula: C9H6O4
Molecular Weight: 178.1415

Identification/Properties


Computed Properties
Molecular Weight:
178.143g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
178.027g/mol
Monoisotopic Mass:
178.027g/mol
Topological Polar Surface Area:
66.8A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
248
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:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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