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4031-52-1

4031-52-1 structural image
Product Name: 3-Cyclohexene-1,2-diol, 2-methyl-5-(1-methylethyl)-, (1S,2S,5R)-
Formula: C10H18O2
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COMPUTED DESCRIPTORS

Molecular Weight 170.25 g/mol
XLogP3 1.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 170.130679813 g/mol
Monoisotopic Mass 170.130679813 g/mol
Topological Polar Surface Area 40.5 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 186
Isotope Atom Count 0
Defined Atom Stereocenter Count 3
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes