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25294-58-0

25294-58-0 structural image
Product Name: 3-(1-HYDROXYCYCLOHEXYL)-2-PROPYNOIC ACID
Formula: C9H12O3
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COMPUTED DESCRIPTORS

Molecular Weight 168.19 g/mol
XLogP3 1.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 168.078644241 g/mol
Monoisotopic Mass 168.078644241 g/mol
Topological Polar Surface Area 57.5 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 237
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