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91031-48-0

Product Name: Fatty acids, C16-18, 2-ethylhexyl esters
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Liquid; Other Solid
Kovats Retention Index 2684

COMPUTED DESCRIPTORS

Molecular Weight 396.7 g/mol
XLogP3 11.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 23
Exact Mass 396.396730897 g/mol
Monoisotopic Mass 396.396730897 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 314
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes