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331461-34-8

331461-34-8 structural image
Product Name: 4-[3-(4-METHYLPHENYL)-3-OXO-1-PROPENYL]PHENYL 2,4,6-TRIMETHYLBENZENESULFONATE
Formula: C25H24O4S
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COMPUTED DESCRIPTORS

Molecular Weight 420.5 g/mol
XLogP3 6.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 420.13953042 g/mol
Monoisotopic Mass 420.13953042 g/mol
Topological Polar Surface Area 68.8 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 679
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes