946726-18-7 Purity
96%
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Specification
The molecular formula is C17H19NO.
The structure was created on 2010-03-29 and modified on 2023-12-30.
Some synonyms include 3-(2-benzylphenoxy)pyrrolidine, 946726-75-6, DTXSID401283328, AKOS012467709, and 3-[2-(phenylmethyl)phenoxy]pyrrolidine.
The molecular weight is 253.34 g/mol.
The IUPAC Name is 3-(2-benzylphenoxy)pyrrolidine.
The InChI is InChI=1S/C17H19NO/c1-2-6-14(7-3-1)12-15-8-4-5-9-17(15)19-16-10-11-18-13-16/h1-9,16,18H,10-13H2.
The Canonical SMILES is C1CNCC1OC2=CC=CC=C2CC3=CC=CC=C3.
The XLogP3-AA value is 3.6.
There is 1 hydrogen bond donor count.
Yes, the compound is canonicalized.