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1331-39-1

1331-39-1 structural image
Product Name: TRIMETHYLHEXANOL
Formula: C9H20O
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COMPUTED DESCRIPTORS

Molecular Weight 144.25 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 4
Exact Mass 144.151415257 g/mol
Monoisotopic Mass 144.151415257 g/mol
Topological Polar Surface Area 20.2 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 86.7
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes