912456-61-2 Purity
96%
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Specification
The molecular formula is C11H15NO.
The molecular weight is 177.24 g/mol.
Some synonyms include 91245-82-8, 1-{4-[(dimethylamino)methyl]phenyl}ethan-1-one, Ethanone, 1-[4-[(dimethylamino)methyl]phenyl]-, and 1-(4-[(dimethylamino)methyl]phenyl)ethan-1-one.
The IUPAC name is 1-[4-[(dimethylamino)methyl]phenyl]ethanone.
The InChIKey is QVUOUGMOYJKOPL-UHFFFAOYSA-N.
The Canonical SMILES representation is CC(=O)C1=CC=C(C=C1)CN(C)C.
The European Community (EC) Number is 847-261-4.
It has 2 hydrogen bond acceptor counts.
The topological polar surface area is 20.3 Ų.
Yes, it is a canonicalized compound according to PubChem.