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60241-53-4

60241-53-4 structural image
Product Name: ISO-METHYL TETRAHYDROIONOL
Formula: C14H28O
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COMPUTED DESCRIPTORS

Molecular Weight 212.37 g/mol
XLogP3 4.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 3
Exact Mass 212.214015512 g/mol
Monoisotopic Mass 212.214015512 g/mol
Topological Polar Surface Area 20.2 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 198
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 4
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes