CAS
927880-89-5 Purity
96%
927880-89-5 Purity
96%
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The molecular formula is C13H17NO.
The molecular weight is 203.28 g/mol.
The IUPAC name is N-[(2-ethyl-1-benzofuran-3-yl)methyl]ethanamine.
The InChI is InChI=1S/C13H17NO/c1-3-12-11(9-14-4-2)10-7-5-6-8-13(10)15-12/h5-8,14H,3-4,9H2,1-2H3.
The InChIKey is ARCYHQZBGUKSJI-UHFFFAOYSA-N.
The canonical SMILES is CCC1=C(C2=CC=CC=C2O1)CNCC.
The CAS number is 92789-38-3.
The XLogP3-AA value is 2.9.
The hydrogen bond donor count is 1.
Yes, it is a canonicalized compound.