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Chemical structure of 3,4-EDMC (hydrochloride)

GC42214

3,4-EDMC (hydrochloride)

Also known as 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(methylamino)propan-1-one;hydrochloride

Methylone is designer cathinone that is structurally similar to the illicit, psychotropic drug 3,4-MDMA

ChemicalCAS30253-44-2MW257.7FormulaC12H15NO3•HCl
CAS number
30253-44-2
Molecular weight
257.7
Formula
C12H15NO3•HCl
Solubility
5mg/mL in DMSO, 5mg/mL in DMF, 5mg/mL in Ethanol
InChIKey
ICPYGVDJAZJHBA-UHFFFAOYSA-N
Catalogue number
GC42214
Brand
GLPBIO
Computed properties PubChem CID 132988640 · TPSA 47.6 Ų · H-bond donors 2 · H-bond acceptors 4
TPSA
47.6 Ų
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
17

SMILES CC(C(=O)C1=CC2=C(C=C1)OCCO2)NC.Cl

Computed descriptors from PubChem (CID 132988640), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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