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Chemical structure of rel-Sertraline-d3 hydrochloride

GC71618

rel-Sertraline-d3 hydrochloride

Also known as (1S,4R)-4-(3,4-dichlorophenyl)-N-(trideuteriomethyl)-1,2,3,4-tetrahydronaphthalen-1-amine;hydrochloride

rel-Sertraline-d3 (hydrochloride) is the deuterium labeled Sertraline hydrochloride

ChemicalCAS1330180-66-9MW345.71FormulaC17H15D3Cl3N
CAS number
1330180-66-9
Molecular weight
345.71
Formula
C17H15D3Cl3N
InChIKey
BLFQGGGGFNSJKA-KSGPAQBCSA-N
Catalogue number
GC71618
Brand
GLPBIO
Computed properties PubChem CID 71752191 · TPSA 12 Ų · H-bond donors 2 · H-bond acceptors 1
TPSA
12 Ų
H-bond donors
2
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
21

SMILES [2H]C([2H])([2H])N[C@H]1CC[C@@H](C2=CC=CC=C12)C3=CC(=C(C=C3)Cl)Cl.Cl

Computed descriptors from PubChem (CID 71752191), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
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