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129518-51-0

129518-51-0 structural image
Product Name: 4-TERT-BUTYL-CALIX[4]ARENE-CROWN-6-COMPLEX
Formula: C54H74O8
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COMPUTED DESCRIPTORS

Molecular Weight 851.2 g/mol
XLogP3 12.8
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 4
Exact Mass 850.53836931 g/mol
Monoisotopic Mass 850.53836931 g/mol
Topological Polar Surface Area 95.8 Ų
Heavy Atom Count 62
Formal Charge 0
Complexity 1170
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