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204190-49-8

204190-49-8 structural image
Product Name: 4-TERT-BUTYLSULFONYLCALIX[4]ARENE
Formula: C40H48O12S4
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COMPUTED DESCRIPTORS

Molecular Weight 849.1 g/mol
XLogP3 8.4
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 12
Rotatable Bond Count 4
Exact Mass 848.20286166 g/mol
Monoisotopic Mass 848.20286166 g/mol
Topological Polar Surface Area 251 Ų
Heavy Atom Count 56
Formal Charge 0
Complexity 1530
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