81930-18-9
Product Name:
4-Cyano-phenyl-4'-trans-heptylcyclohexylbenzoate
Formula:
C27H33NO2
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COMPUTED DESCRIPTORS
Molecular Weight | 403.6 g/mol |
---|---|
XLogP3 | 9.1 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 10 |
Exact Mass | 403.251129295 g/mol |
Monoisotopic Mass | 403.251129295 g/mol |
Topological Polar Surface Area | 50.1 Ų |
Heavy Atom Count | 30 |
Formal Charge | 0 |
Complexity | 541 |
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 |