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112901-67-4

112901-67-4 structural image
Product Name: (S)-4-[(1-METHYLHEPTYLOXY)CARBONYL]PHENYL 4'-OCTYLOXY-4-BIPHENYLCARBOXYLATE
Formula: C36H46O5
Synonyms: (S )-MHPOBC;(S)-4-[(1-Methylheptyloxy)carbonyl]phenyl-4′-octyloxy-4-biphenyl carboxylate
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COMPUTED DESCRIPTORS

Molecular Weight 558.7 g/mol
XLogP3 11.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 20
Exact Mass 558.33452456 g/mol
Monoisotopic Mass 558.33452456 g/mol
Topological Polar Surface Area 61.8 Ų
Heavy Atom Count 41
Formal Charge 0
Complexity 699
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes