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Chemical structure of Pseudooxynicotine-d4 hydrochloride

GC69773

Pseudooxynicotine-d4 hydrochloride

Also known as 4-(methylamino)-1-(2,4,5,6-tetradeuterio-3-pyridinyl)butan-1-one;dihydrochloride

Pseudooxynicotine-d4 (hydrochloride) is the deuterated form of Pseudooxynicotine hydrochloride

ChemicalCAS764661-23-6MW255.18FormulaC10H12D4Cl2N2O
CAS number
764661-23-6
Molecular weight
255.18
Formula
C10H12D4Cl2N2O
InChIKey
MFQNPOXUAKSUPV-FPAVXYEGSA-N
Catalogue number
GC69773
Brand
GLPBIO
Computed properties PubChem CID 71771874 · TPSA 42 Ų · H-bond donors 3 · H-bond acceptors 3
TPSA
42 Ų
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
15

SMILES [2H]C1=C(C(=C(N=C1[2H])[2H])C(=O)CCCNC)[2H].Cl.Cl

Computed descriptors from PubChem (CID 71771874), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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