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1881275-59-7

1881275-59-7 structural image
Product Name: DIMETHYL (1R,2R)-4,5-DIMETHYL-4-CYCLOHEXENE-1,2-DICARBOXYLATE
Formula: C12H18O4
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COMPUTED DESCRIPTORS

Molecular Weight 226.27 g/mol
XLogP3 0.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 226.12050905 g/mol
Monoisotopic Mass 226.12050905 g/mol
Topological Polar Surface Area 52.6 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 298
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes