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1121-97-7

1121-97-7 structural image
Product Name: 5-HYDROXYMETHYL-5-METHYL-1,3-DIOXANE
Formula: C6H12O3
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COMPUTED DESCRIPTORS

Molecular Weight 132.16 g/mol
XLogP3 -0.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 132.078644241 g/mol
Monoisotopic Mass 132.078644241 g/mol
Topological Polar Surface Area 38.7 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 86.3
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