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50649-64-4

50649-64-4 structural image
Product Name: 4-N-PENTYLBENZOIC ACID 4'-N-OCTYLOXYPHENYL ESTER
Formula: C26H36O3
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COMPUTED DESCRIPTORS

Molecular Weight 396.6 g/mol
XLogP3 9.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 15
Exact Mass 396.26644501 g/mol
Monoisotopic Mass 396.26644501 g/mol
Topological Polar Surface Area 35.5 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 406
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