CAS
946759-52-0 Purity
96%
946759-52-0 Purity
96%
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Specification
The molecular formula is C10H11Cl2NO.
The molecular weight is 232.10 g/mol.
The IUPAC name is 3-(2,4-dichlorophenoxy)pyrrolidine.
The InChI is InChI=1S/C10H11Cl2NO/c11-7-1-2-10(9(12)5-7)14-8-3-4-13-6-8/h1-2,5,8,13H,3-4,6H2.
The InChIKey is GBIXEZKLXLWGNZ-UHFFFAOYSA-N.
It has 1 hydrogen bond donor count.
The XLogP3-AA value is 2.9.
It has 2 hydrogen bond acceptor counts.
The topological polar surface area is 21.3 Ų.
Yes, it is a canonicalized compound.