N-Desmethyl Toremifene Hydrochloride Salt

Analyte Name

N-Desmethyl Toremifene hydrochloride

CAS Number

176671-73-1

Molecular Formula

C25 H26 Cl N O . H Cl

Molecular Weight

428.39

Accurate Mass

427.147

SMILES

Cl.CNCCOc1ccc(cc1)\C(=C(\CCCl)/c2ccccc2)\c3ccccc3

InChI

InChI=1S/C25H26ClNO.ClH/c1-27-18-19-28-23-14-12-22(13-15-23)25(21-10-6-3-7-11-21)24(16-17-26)20-8-4-2-5-9-20;/h2-15,27H,16-19H2,1H3;1H/b25-24-;

IUPAC

2-[4-[(Z)-4-chloro-1,2-diphenyl-but-1-enyl]phenoxy]-N-methyl-ethanamine;hydrochloride

Alternate CAS Number

Free base: 110503-61-2

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Toremifene Citrate