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42232-87-1

42232-87-1 structural image
Product Name: ARACHIDIC ACID BEHENYL ESTERCRYSTALLINE
Formula: C42H84O2
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 4346.67

COMPUTED DESCRIPTORS

Molecular Weight 621.1 g/mol
XLogP3 20.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 40
Exact Mass 620.64713192 g/mol
Monoisotopic Mass 620.64713192 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 44
Formal Charge 0
Complexity 516
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