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439107-95-6

439107-95-6 structural image
Product Name: 2-PROPYNYL 2-[3,5-DI(TERT-BUTYL)-4-HYDROXYPHENYL]-2-(2-PROPYNYLOXY)ACETATE
Formula: C22H28O4
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COMPUTED DESCRIPTORS

Molecular Weight 356.5 g/mol
XLogP3 4.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 8
Exact Mass 356.19875937 g/mol
Monoisotopic Mass 356.19875937 g/mol
Topological Polar Surface Area 55.8 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 551
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes