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Ethylone (hydrochloride) polymorph B

Item No. 9002749

Technical Information
Formal Name
1-(1,3-benzodioxol-5-yl)-2-(ethylamino)-1-propanone, monohydrochloride
CAS Number
1454266-19-3
Molecular Formula
C12H15NO3 • HCl
Formula Weight
Purity
≥98%
Formulation
A crystalline solid
DMF: 0.5 mg/mlDMSO: 5 mg/mlMethanol: 5 mg/mlPBS (pH 7.2): 10 mg/ml
λmax
234, 280, 317 nm
SMILES
CC(NCC)C(C1=CC(OCO2)=C2C=C1)=O.Cl
InChi Code
InChI=1S/C12H15NO3.ClH/c1-3-13-8(2)12(14)9-4-5-10-11(6-9)16-7-15-10;/h4-6,8,13H,3,7H2,1-2H3;1H
InChi Key
FQUJUYOEUQPDDR-UHFFFAOYSA-N
Regulatory Information
DEA Schedule
I
Shipping & Storage Information
Storage
-20°C
Shipping
Room temperature in continental US; may vary elsewhere
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    Product Description

    Ethylone (hydrochloride) polymorph B (Item No. 9002749) is an analytical reference standard that is structurally categorized as a cathinone. Ethylone can exist in two conformations (polymorphs) at the C-C bond linking the side chain to the aromatic ring.1 These polymorphs are identical by mass spectroscopy and nuclear magnetic resonance (NMR), but differ when analyzed by Fourier transform infrared spectroscopy (FTIR), FT-Raman, X-ray diffraction, and solid-state NMR spectroscopy.2 The physiological and toxicological properties of this compound are not known. This product is intended for research and forensic applications.

    WARNING This product is not for human or veterinary use.

    References & Product Citations
    Product Description References

    1. Cameron, T.S., Grossert, J.S., Maheux, C.R., et alInversion twinning in a second polymorph of the hydrochloride salt of the recreational drug ethylone. Acta Crystallogr. C Struct. Chem. 71(Pt.4), 266-270 (2015).

    2. Maheux, C.R., Alarcon, I.Q., Copeland, C.R., et alIdentification of polymorphism in ethylone hydrochloride: Synthesis and characterization. Drug Test. Anal. 092015, (2015).