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Chemical structure of rac-Rotigotine Hydrochloride

GC37067

rac-Rotigotine Hydrochloride

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

rac-Rotigotine Hydrochloride is a racemate of Rotigotine

ChemicalCAS102120-99-0MW351.93FormulaC19H26ClNOS
CAS number
102120-99-0
Molecular weight
351.93
Formula
C19H26ClNOS
Solubility
DMSO： ≥ 50 mg/mL (142·07 mM)
InChIKey
CEXBONHIOKGWNU-UHFFFAOYSA-N
Catalogue number
GC37067
Brand
GLPBIO
Computed properties PubChem CID 6917969 · 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 CCCN(CCC1=CC=CS1)C2CCC3=C(C2)C=CC=C3O.Cl

Computed descriptors from PubChem (CID 6917969), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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