CAS
947685-14-5 Purity
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947685-14-5 Purity
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The molecular formula is C11H15NO2.
The molecular weight is 193.24 g/mol.
The IUPAC name is 1-(2-amino-5-ethyl-4-methoxyphenyl)ethanone.
The InChI code is InChI=1S/C11H15NO2/c1-4-8-5-9(7(2)13)10(12)6-11(8)14-3/h5-6H,4,12H2,1-3H3.
The InChIKey is LSMXGHGQJXRGKN-UHFFFAOYSA-N.
The canonical SMILES is CCC1=CC(=C(C=C1OC)N)C(=O)C.
The CAS number is 947691-62-5.
The XLogP3-AA value is 2.2.
It has 1 hydrogen bond donor count.
It has 3 rotatable bond counts.