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331460-51-6

331460-51-6 structural image
Product Name: 4-[3-(4-METHYLPHENYL)-3-OXO-1-PROPENYL]PHENYL 2-THIOPHENECARBOXYLATE
Formula: C21H16O3S
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COMPUTED DESCRIPTORS

Molecular Weight 348.4 g/mol
XLogP3 5.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 348.08201554 g/mol
Monoisotopic Mass 348.08201554 g/mol
Topological Polar Surface Area 71.6 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 485
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