CAS
94021-50-8 Purity
96%
94021-50-8 Purity
96%
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Specification
The molecular formula is C12H18O.
The molecular weight is 178.27 g/mol.
It was created on August 20, 2009.
The IUPAC name is 3,5-dimethyl-4-oxatetracyclo[6.2.1.0 2,7 .0 3,5 ]undecane.
The InChIKey is PALRMMBVTSAXSM-UHFFFAOYSA-N.
The Canonical SMILES is CC12CC3C4CCC(C4)C3C1(O2)C.
The CAS number is 94021-60-0.
The XLogP3-AA value is 2.7.
It has one hydrogen bond acceptor.
Yes, it is a canonicalized compound in PubChem.