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110729-26-5

110729-26-5 structural image
Product Name: Benzenepropanoic acid,3-(1,1-dimethylethyl)-4-hydroxy-,octadecyl ester
Formula: C31H54O3
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COMPUTED DESCRIPTORS

Molecular Weight 474.8 g/mol
XLogP3 12.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 22
Exact Mass 474.40729558 g/mol
Monoisotopic Mass 474.40729558 g/mol
Topological Polar Surface Area 46.5 Ų
Heavy Atom Count 34
Formal Charge 0
Complexity 482
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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