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Chemical structure of Ambroxol-d5 (hydrochloride)

GC90781

Ambroxol-d5 (hydrochloride)

Also known as 4-[(2-amino-3,5-dibromophenyl)methylamino]-1,2,2,6,6-pentadeuteriocyclohexan-1-ol;hydrochloride

An internal standard for the quantification of ambroxol

ChemicalCAS2741380-71-0MW419.6FormulaC13H13Br2D5N2O • HCl
CAS number
2741380-71-0
Molecular weight
419.6
Formula
C13H13Br2D5N2O • HCl
Solubility
DMSO ： ≥ 20 mg/mL (47·67 mM); DMF ： ≥ 20 mg/mL (47·67 mM)
InChIKey
QNVKOSLOVOTXKF-LIZULUGVSA-N
Catalogue number
GC90781
Brand
GLPBIO
Computed properties PubChem CID 57347714 · TPSA 58.3 Ų · H-bond donors 4 · H-bond acceptors 3
TPSA
58.3 Ų
H-bond donors
4
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
19

SMILES [2H]C1(CC(CC(C1([2H])O)([2H])[2H])NCC2=C(C(=CC(=C2)Br)Br)N)[2H].Cl

Computed descriptors from PubChem (CID 57347714), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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