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99314-01-9

99314-01-9 structural image
Product Name: 4-TERT-BUTYL-CALIX[4]ARENE-CROWN-5-COMPLEX
Formula: C52H70O7
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COMPUTED DESCRIPTORS

Molecular Weight 636.9 g/mol
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 1
Exact Mass 636.38147475 g/mol
Monoisotopic Mass 636.38147475 g/mol
Topological Polar Surface Area 46.2 Ų
Heavy Atom Count 47
Formal Charge 0
Complexity 670
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 2
Compound Is Canonicalized Yes