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Chemical structure of 4'-Hydroxy diclofenac-d4

GC75575

4'-Hydroxy diclofenac-d4

Also known as 2-[2,3,4,5-tetradeuterio-6-(2,6-dichloro-4-hydroxyanilino)phenyl]acetic acid

4'-Hydroxy diclofenac-d4 is the deuterium labeled 4'-Hydroxy diclofenac

ChemicalCAS254762-27-1MW316.17FormulaC14H7D4Cl2NO3
CAS number
254762-27-1
Molecular weight
316.17
Formula
C14H7D4Cl2NO3
Solubility
DMF： ≥ 30 mg/mL (94·89 mM); Ethanol： ≥ 30 mg/mL (94·89 mM); DMSO： ≥ 30 mg/mL (94·89 mM)
InChIKey
KGVXVPRLBMWZLG-RHQRLBAQSA-N
Catalogue number
GC75575
Brand
GLPBIO
Computed properties PubChem CID 10805325 · XLogP 3.7 · TPSA 69.6 Ų · H-bond donors 3
XLogP
3.7
TPSA
69.6 Ų
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
20

SMILES [2H]C1=C(C(=C(C(=C1[2H])CC(=O)O)NC2=C(C=C(C=C2Cl)O)Cl)[2H])[2H]

Computed descriptors from PubChem (CID 10805325), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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