143-08-8 Purity
99%+
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Specification
The molecular formula of 1-Ethynyl-2,2,6-trimethylcyclohexanol is C11H18O.
The synonyms for 1-Ethynyl-2,2,6-trimethylcyclohexanol are 26005-41-4, 41613-59-6, and 1-ethynyl-2,2,6-trimethylcyclohexan-1-ol.
The molecular weight of 1-Ethynyl-2,2,6-trimethylcyclohexanol is 166.26 g/mol.
The IUPAC name of 1-Ethynyl-2,2,6-trimethylcyclohexanol is 1-ethynyl-2,2,6-trimethylcyclohexan-1-ol.
The InChI of 1-Ethynyl-2,2,6-trimethylcyclohexanol is InChI=1S/C11H18O/c1-5-11(12)9(2)7-6-8-10(11,3)4/h1,9,12H,6-8H2,2-4H3.
The InChIKey of 1-Ethynyl-2,2,6-trimethylcyclohexanol is PQQOQXUYGRGYEK-UHFFFAOYSA-N.
The canonical SMILES of 1-Ethynyl-2,2,6-trimethylcyclohexanol is CC1CCCC(C1(C#C)O)(C)C.
The CAS number of 1-Ethynyl-2,2,6-trimethylcyclohexanol is 26005-41-4.
The XLogP3-AA value of 1-Ethynyl-2,2,6-trimethylcyclohexanol is 2.5.
Yes, 1-Ethynyl-2,2,6-trimethylcyclohexanol is a canonicalized compound.