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7414-45-1

7414-45-1 structural image
Product Name: 2,4-DIMETHYLOCTANOIC ACID
Formula: C10H20O2
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COMPUTED DESCRIPTORS

Molecular Weight 172.26 g/mol
XLogP3 3.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 6
Exact Mass 172.146329876 g/mol
Monoisotopic Mass 172.146329876 g/mol
Topological Polar Surface Area 37.3 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 132
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes