1-Benzopyrylium, 3,5,7-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-,chloride


Chemical Name: 1-Benzopyrylium, 3,5,7-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-,chloride
CAS Number: 134-01-0
Product Number: AG0070YI(AGN-PC-0PK6GP)
Synonyms:
MDL No:
Molecular Formula: C16H13ClO6
Molecular Weight: 336.7238

Identification/Properties


Computed Properties
Molecular Weight:
336.724g/mol
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
2
Exact Mass:
336.04g/mol
Monoisotopic Mass:
336.04g/mol
Topological Polar Surface Area:
91.2A^2
Heavy Atom Count:
23
Formal Charge:
0
Complexity:
378
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:
2
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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