97600-39-0
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 |