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Chemical structure of Acetylcholine-d16 bromide

GC76030

Acetylcholine-d16 bromide

Also known as [1,1,2,2-tetradeuterio-2-(2,2,2-trideuterioacetyl)oxyethyl]-tris(trideuteriomethyl)azanium bromide

Acetylcholine-d16 (bromide) is the deuterium labeled Acetylcholine bromide

ChemicalCAS347841-43-4MW242.21FormulaC7D16BrNO2
CAS number
347841-43-4
Molecular weight
242.21
Formula
C7D16BrNO2
Solubility
H2O： 250 mg/mL (1032·16 mM; Need ultrasonic)
InChIKey
ZEHGKSPCAMLJDC-ZHEXTGARSA-M
Catalogue number
GC76030
Brand
GLPBIO
Computed properties PubChem CID 90472136 · TPSA 26.3 Ų · H-bond donors 0 · H-bond acceptors 3
TPSA
26.3 Ų
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
11

SMILES [2H]C([2H])([2H])C(=O)OC([2H])([2H])C([2H])([2H])[N+](C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H].[Br-]

Computed descriptors from PubChem (CID 90472136), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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