CAS
93941-86-7 Purity
96%
93941-86-7 Purity
96%
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Specification
The molecular formula is C15H22ClNO2.
It was created on December 5, 2007.
The IUPAC Name is benzyl-dimethyl-(1-prop-2-enoyloxypropan-2-yl)azanium; chloride.
The InChIKey is DWNMRHBGZATFST-UHFFFAOYSA-M.
The Canonical SMILES is CC(COC(=O)C=C)[N+](C)(C)CC1=CC=CC=C1.[Cl-].
The CAS number is 93941-91-4.
The molecular weight is 283.79 g/mol.
There are 3 hydrogen bond acceptors.
There are 7 rotatable bond counts.
Yes, the compound is canonicalized.