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90936-85-9

90936-85-9 structural image
Product Name: 1-PYRENEHEXANOIC ACID
Formula: C22H20O2
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COMPUTED DESCRIPTORS

Molecular Weight 316.4 g/mol
XLogP3 6.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 6
Exact Mass 316.146329876 g/mol
Monoisotopic Mass 316.146329876 g/mol
Topological Polar Surface Area 37.3 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 445
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