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5465-18-9

5465-18-9 structural image
Product Name: 4-(3,4-dimethylphenyl)butanoic acid
Formula: C12H16O2
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COMPUTED DESCRIPTORS

Molecular Weight 192.25 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 4
Exact Mass 192.115029749 g/mol
Monoisotopic Mass 192.115029749 g/mol
Topological Polar Surface Area 37.3 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 189
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