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97600-39-0

97600-39-0 structural image
Product Name: 4-TERT-BUTYLCALIX[4]ARENE-TETRAACETIC ACID TETRAETHYL ESTER
Formula: C60H80O12
Synonyms: 4-tert-Butylcalix[4]arene-tetraacetic acid tetraethyl ester
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COMPUTED DESCRIPTORS

Molecular Weight 993.3 g/mol
XLogP3 15.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 12
Rotatable Bond Count 24
Exact Mass 992.56497798 g/mol
Monoisotopic Mass 992.56497798 g/mol
Topological Polar Surface Area 142 Ų
Heavy Atom Count 72
Formal Charge 0
Complexity 1420
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

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product:97600-39-0 98%
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