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78606-96-9

78606-96-9 structural image
Product Name: 2-(2-METHYLBENZYL)-MALONIC ACID
Formula: C11H12O4
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COMPUTED DESCRIPTORS

Molecular Weight 208.21 g/mol
XLogP3 1.8
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 208.07355886 g/mol
Monoisotopic Mass 208.07355886 g/mol
Topological Polar Surface Area 74.6 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 235
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