CAS 1246820-59-6

1-(1,3-Benzodioxol-5-yl)-2-(ethyl-1,1,2,2,2-d₅-amino)-1-propanone

Description:

1-(1,3-Benzodioxol-5-yl)-2-(ethyl-1,1,2,2,2-d5-amino)-1-propanone, identified by its CAS number 1246820-59-6, is a synthetic organic compound characterized by its complex structure, which includes a benzodioxole moiety and a propanone functional group. This compound features a deuterated ethyl amino group, which can influence its chemical behavior and isotopic labeling in research applications. The presence of the benzodioxole ring suggests potential interactions with biological systems, as this structure is often associated with various pharmacological activities. The compound is likely to exhibit moderate solubility in organic solvents and may have specific reactivity patterns due to the functional groups present. Its unique isotopic labeling can be advantageous in studies involving metabolic pathways or drug development, allowing for precise tracking of the compound in biological systems. Overall, this substance represents a specialized compound with potential applications in medicinal chemistry and pharmacology.

Formula: C₁₂H₁₀D₅NO₃

InChI: InChI=1S/C12H15NO3/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/i1D3,3D2

InChI key: InChIKey=MJEMIOXXNCZZFK-WNWXXORZSA-N

SMILES: C(C(NC(C([2H])([2H])[2H])([2H])[2H])C)(=O)C=1C=C2C(=CC1)OCO2

Synonyms:

• 1-(1,3-Benzodioxol-5-yl)-2-(ethyl-1,1,2,2,2-d5-amino)-1-propanone
• 1-Propanone, 1-(1,3-benzodioxol-5-yl)-2-(ethyl-1,1,2,2,2-d5-amino)-

Ethylone-d5

Controlled Product

CAS: 1246820-59-6

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Formula: C₁₂H₁₅NO₃

Purity: Min. 95%

Molecular weight: 226.28 g/mol

Ref: 3D-WZB82059