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13463-98-4

13463-98-4 structural image
Product Name: calcium abietate
Formula: C20H32CaO2
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COMPUTED DESCRIPTORS

Molecular Weight 643.0 g/mol
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 642.3961012 g/mol
Monoisotopic Mass 642.3961012 g/mol
Topological Polar Surface Area 80.3 Ų
Heavy Atom Count 45
Formal Charge 0
Complexity 536
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 8
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 3
Compound Is Canonicalized Yes