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2-[(RS)-(4-Methylphenyl)phenylmethoxy]-N,N-dimethylethanamine hydrochloride

SIAL/62226 - pharmaceutical impurity standard

Synonym: Diphenhydramine impurity B (PhEur); 2-[(4-Methyl-α-phenylbenzyl)oxy]ethyl(dimethyl)ammonium chloride; 4-Methyldiphenhydramine hydrochloride; N,N-Dimethyl-2-[(4-methylphenyl)phenylmethoxy]ethanamin hydrochloride; Neobenodine

CAS Number: 4024-34-4
Empirical Formula (Hill Notation): C18H23NO · HCl
Molecular Weight: 305.84
EC Number: 223-691-2
MDL Number: MFCD00550569
Linear Formula: C18H23NO · HCl
Product Type: Chemical
Catalog Number PKG Qty. Price Quantity
45-62226-50MG 50 mg
 $335.00
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application(s) forensics and toxicology
pharmaceutical (small molecule)
assay ≥98.0% (HPLC)
format neat
impurities ≤0.5% water
InChI 1S/C18H23NO.ClH/c1-15-9-11-17(12-10-15)18(20-14-13-19(2)3)16-7-5-4-6-8-16;/h4-12,18H,13-14H2,1-3H3;1H
InChI key BNFDLGUZDIWYJK-UHFFFAOYSA-N
Quality Level 100 
shelf life limited shelf life, expiry date on the label
SMILES string CN(C)CCOC(C1=CC=C(C)C=C1)C2=CC=CC=C2.Cl
Symbol GHS07  GHS07
Signal word Warning
Hazard statements H302
Precautionary statements P301 + P312 + P330
RIDADR NONH for all modes of transport
WGK Germany WGK 1
Flash Point(F) Not applicable
Flash Point(C) Not applicable
Purity ≥98.0% (HPLC)
UNSPSC 41116107

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