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146502-80-9

146502-80-9 structural image
Product Name: (-)-(1R,2R,5S)-NEOMENTHYL ACETATE
Formula: C12H22O2
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 1264 1276.6 1264 1262

COMPUTED DESCRIPTORS

Molecular Weight 198.30 g/mol
XLogP3 3.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 3
Exact Mass 198.161979940 g/mol
Monoisotopic Mass 198.161979940 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 199
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