1'-Oxosafrole-PEA is an adduct of phenylethylamine and 1'-oxosafrole. This adduct might form in vivo. 1'-Oxosafrole has been shown to create dimethylamine, piperidine, and pyrrolidine adducts in vivo (see the article 1'-Oxosafrole for more details).

This adduct might form spontaneously. 1'-Oxosafrole has been shown to react with a number of amines at room temperature without a catalyst (see the article 1'-Oxosafrole for more details).

See Also

Chemical Properties

Synonyms: 1'-ketosafrole-phenylethylamine; 1'-oxosafrole-phenylethylamine
ChemSpider ID: 25699155
Molecular Weight: 297.38
Molecular Formula: C18H19NO3
Systematic name: 1-(1,3-benzodioxol-5-yl)-3-(2-phenylethylamino)propan-1-one
InChI: InChI=1S/C18H19NO3/c20-16(15-6-7-17-18(12-15)22-13-21-17)9-11-19-10-8-14-4-2-1-3-5-14/h1-7,12,19H,8-11,13H2
XLogP3: 2.88[1]
Canonical SMILES: C3OC1=C(C=C(C=C1)C(=O)CCNCCC2=CC=CC=C2)O3

1. Value calculated using Virtual Computational Chemistry Laboratory's online ALOGPS 2.1 program
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