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Chemical structure of (Rac)-Rotigotine-d3 hydrochloride

GC71284

(Rac)-Rotigotine-d3 hydrochloride

Also known as 6-[2-thiophen-2-ylethyl(3,3,3-trideuteriopropyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol;hydrochloride

(Rac)-Rotigotine-d3 hydrochloride is a deuterium labeled (Rac)-Rotigotine (hydrochloride)

ChemicalCAS1215846-20-0MW354.95FormulaC19H23D3ClNOS
CAS number
1215846-20-0
Molecular weight
354.95
Formula
C19H23D3ClNOS
InChIKey
CEXBONHIOKGWNU-NIIDSAIPSA-N
Catalogue number
GC71284
Brand
GLPBIO
Computed properties PubChem CID 57347712 · TPSA 51.7 Ų · H-bond donors 2 · H-bond acceptors 3
TPSA
51.7 Ų
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
23

SMILES [2H]C([2H])([2H])CCN(CCC1=CC=CS1)C2CCC3=C(C2)C=CC=C3O.Cl

Computed descriptors from PubChem (CID 57347712), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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