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Chemical structure of Mexiletine D6 hydrochloride

GC39618

Mexiletine D6 hydrochloride

Also known as 1,1,1,2,3,3-hexadeuterio-3-(2,6-dimethylphenoxy)propan-2-amine;hydrochloride

Mexiletine D6 hydrochloride (KOE-1173-d6 hydrochloride) is a deuterium labeled Mexiletine hydrochloride (KOE-1173 hydrochloride)

ChemicalCAS1329835-60-0MW221.76FormulaC11H12D6ClNO
CAS number
1329835-60-0
Molecular weight
221.76
Formula
C11H12D6ClNO
Solubility
DMSO ： 50 mg/mL (225·47 mM; Need ultrasonic)
InChIKey
NFEIBWMZVIVJLQ-SJPQGYSLSA-N
Catalogue number
GC39618
Brand
GLPBIO
Computed properties PubChem CID 71750725 · TPSA 35.3 Ų · H-bond donors 2 · H-bond acceptors 2
TPSA
35.3 Ų
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
14

SMILES [2H]C([2H])([2H])C([2H])(C([2H])([2H])OC1=C(C=CC=C1C)C)N.Cl

Computed descriptors from PubChem (CID 71750725), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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