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Chemical structure of Pirfenidone-d5

GC40197

Pirfenidone-d5

Also known as 5-methyl-1-(2,3,4,5,6-pentadeuteriophenyl)pyridin-2-one

Pirfenidone-d5 is intended for use as an internal standard for the quantification of pirfenidone by GC- or LC-MS

ChemicalCAS1020719-62-3MW190.3FormulaC12H6D5NO
CAS number
1020719-62-3
Molecular weight
190.3
Formula
C12H6D5NO
Solubility
DMSO ： 100 mg/mL (525·62 mM; ultrasonic and warming and heat to 60°C)
InChIKey
ISWRGOKTTBVCFA-VIQYUKPQSA-N
Catalogue number
GC40197
Brand
GLPBIO
Computed properties PubChem CID 71434117 · XLogP 1.9 · TPSA 20.3 Ų · H-bond donors 0
XLogP
1.9
TPSA
20.3 Ų
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
14

SMILES [2H]C1=C(C(=C(C(=C1[2H])[2H])N2C=C(C=CC2=O)C)[2H])[2H]

Computed descriptors from PubChem (CID 71434117), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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