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Chemical structure of 3,4-Ethylenedioxy U-47700 (hydrochloride)

GC42215

3,4-Ethylenedioxy U-47700 (hydrochloride)

Also known as N-[(1R,2R)-2-(dimethylamino)cyclohexyl]-N-methyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide;hydrochloride

3,4-Ethylenedioxy U-47700 (hydrochloride) is an analytical reference standard that is structurally similar to known opioids

ChemicalCAS2749619-09-6MW354.9FormulaC18H26N2O3•HCl
CAS number
2749619-09-6
Molecular weight
354.9
Formula
C18H26N2O3•HCl
Solubility
DMF： 20 mg/ml,DMSO： 20 mg/ml,Ethanol： 20 mg/ml,PBS (pH 7·2)： 1 mg/ml
InChIKey
ACQJGQDTEWZSLN-CTHHTMFSSA-N
Catalogue number
GC42215
Brand
GLPBIO
Computed properties PubChem CID 137700297 · TPSA 42 Ų · H-bond donors 1 · H-bond acceptors 4
TPSA
42 Ų
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
24

SMILES CN(C)[C@@H]1CCCC[C@H]1N(C)C(=O)C2=CC3=C(C=C2)OCCO3.Cl

Computed descriptors from PubChem (CID 137700297), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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