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4-(2-Piperidinoethoxy)benzoic acid-[d4] hydrochloride

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4-(2-Piperidinoethoxy)benzoic acid-[d4] hydrochloride

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General Information
Catalog: BLP-006151
CAS: 1246815-60-0
Molecular Formula: C14H15D4NO3.HCl
Molecular Weight: 289.79

Chemical Structure

Description	4-(2-Piperidinoethoxy)benzoic acid-[d4] hydrochloride is the labelled analogue of 4-(2-Piperidinoethoxy)benzoic acid hydrochloride, which is an intermediate in the synthesis of Raloxifene hydrochloride.
Synonyms	4-[2-(1-Piperidinyl)ethoxy-d4]benzoic Acid, Hydrochloride Salt; 4-(2-Piperidinoethoxy)benzoic acid-d4 hydrochloride; 4-(2-(Piperidin-1-yl)ethoxy)benzoic acid-d4 hydrochloride
IUPAC Name	4-(1,1,2,2-tetradeuterio-2-piperidin-1-ylethoxy)benzoic acid;hydrochloride
Related CAS	84449-80-9 (unlabelled) 89407-98-7 (unlabelled free base)
Canonical SMILES	C1CCN(CC1)CCOC2=CC=C(C=C2)C(=O)O.Cl
InChI	InChI=1S/C14H19NO3.ClH/c16-14(17)12-4-6-13(7-5-12)18-11-10-15-8-2-1-3-9-15;/h4-7H,1-3,8-11H2,(H,16,17);1H/i10D2,11D2;
InChI Key	CMVTYSMYHSVDIU-DEHBLRELSA-N
Melting Point	263-275°C (dec.)
Purity	≥95%
Solubility	Soluble in DMF, Hot Ethanol, Hot Water
Appearance	White Solid
Storage	Store at -20°C under inert atmosphere