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65629-01-8

65629-01-8 structural image
Product Name: Benzoic acid, 4-(octyloxy)-, 4-(pentyloxy)phenyl ester
Formula: C26H36O4
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COMPUTED DESCRIPTORS

Molecular Weight 412.6 g/mol
XLogP3 8.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 16
Exact Mass 412.26135963 g/mol
Monoisotopic Mass 412.26135963 g/mol
Topological Polar Surface Area 44.8 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 423
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