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1236-72-2

1236-72-2 structural image
Product Name: 1,3,5(10)-ESTRATRIEN-2,3,16ALPHA,17BETA-TETROL 2-METHYL ETHER
Formula: C19H26O4
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COMPUTED DESCRIPTORS

Molecular Weight 318.4 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 318.18310931 g/mol
Monoisotopic Mass 318.18310931 g/mol
Topological Polar Surface Area 69.9 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 455
Isotope Atom Count 0
Defined Atom Stereocenter Count 6
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes