94386-58-0 Purity
96%
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Specification
The molecular formula is C10H16O2.
It was first created on August 9, 2005.
The molecular weight is 168.23 g/mol.
The IUPAC name is [(1R,3S)-3-ethenylcyclohexyl] acetate.
The InChI is InChI=1S/C10H16O2/c1-3-9-5-4-6-10(7-9)12-8(2)11/h3,9-10H,1,4-7H2,2H3/t9-,10+/m0/s1.
There are 2 hydrogen bond acceptors.
The topological polar surface area is 26.3 Ų.
There are 2 defined atom stereocenters.
The XLogP3-AA value is 2.5.
Yes, it is a canonicalized compound.