1-Nonanone, 1-(3,4,5-trihydroxyphenyl)-


Chemical Name: 1-Nonanone, 1-(3,4,5-trihydroxyphenyl)-
CAS Number: 100079-26-3
Product Number: AG01ENI9(AGN-PC-0KOO6V)
Synonyms:
MDL No:
Molecular Formula: C15H22O4
Molecular Weight: 266.3328

Identification/Properties


Computed Properties
Molecular Weight:
266.337g/mol
XLogP3:
4.1
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
8
Exact Mass:
266.152g/mol
Monoisotopic Mass:
266.152g/mol
Topological Polar Surface Area:
77.8A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
255
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


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