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214149-42-5

214149-42-5 Structure

214149-42-5 Structure
IdentificationBack Directory
[Name]

3,4-Dichloromethylphenidate HCl
[CAS]

214149-42-5
[Synonyms]

3,4-Dichloromethylphenidate HCl
(±)-THREO-3,4-DICHLOROMETHYLPHENIDATE HCL
3,4-Dichloromethylphenidate Hydrochloride
(+/-)-threo-3,4-Dichloromethylphenidate HCl
(±)-threo-3,4-Dichloromethylphenidate (hydrochloride)
(alphaR,2R)-rel-alpha-(3,4-Dichlorophenyl)-2-piperidineacetic acid methyl ester hydrochloride
[Molecular Formula]

C14H18Cl3NO2
[MDL Number]

MFCD28040462
[MOL File]

214149-42-5.mol
[Molecular Weight]

338.65
Chemical PropertiesBack Directory
[storage temp. ]

-20°C
[form ]

A neat solid
[InChI]

1S/C14H17Cl2NO2.ClH/c1-19-14(18)13(12-4-2-3-7-17-12)9-5-6-10(15)11(16)8-9;/h5-6,8,12-13,17H,2-4,7H2,1H3;1H/t12-,13-;/m1./s1
[InChIKey]

DJQISAOWJXQDPU-OJERSXHUSA-N
[SMILES]

O=C(OC)[C@@H]([C@@]1([H])CCCCN1)C2=CC=C(Cl)C(Cl)=C2.[H]Cl
Safety DataBack Directory
[RIDADR ]

UN1230 - class 3 - PG 2 - Methanol, solution
[WGK Germany ]

WGK 2
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

Acute Tox. 3 Dermal
Acute Tox. 3 Inhalation
Acute Tox. 3 Oral
Flam. Liq. 2
STOT SE 1
Hazard InformationBack Directory
[Description]

(±)-threo-3,4-Dichloromethylphenidate (hydrochloride) (Item No. 18588) is an analytical reference material that is structurally categorized as an amphetamine. Its threo-diastereomer, 3,4-CTMP, can inhibit dopamine uptake through the dopamine transporter with an IC50 value of 65 nM in rat striatal tissue.1 This product is intended for research and forensic studies.WARNING This product is not for human or veterinary use.
[General Description]

3,4-Dichloromethylphenidate, also known as 3,4-CTMP, is a structural analogue of methylphenidate (Ritalin). 3,4-CTMP is reportedly seven times more potent than methylphenidate and is sold online as a novel psychoactive stimulant. This certified Snap-N-Spike? solution standard is applicable for use in LC/MS or GC/MS applications such as urine drug testing, clinical toxicology and forensic analysis.
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