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Flecainide Impurity D

CAT: 0013-GTR19176114-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19176114-01Size:50 mg
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Description
Flecainide Impurity D is a synthetic intermediate used in the pharmaceutical development of the antiarrhythmic agent flecainide. It serves as a key reference standard in analytical research for quality control and impurity profiling during drug manufacturing processes.
CAS Number
35480-52-5
Product Name Alternative
Flecainide Impurity D
Field of Research
Pharmacology & Drug Discovery
Purity
99.13% (May vary between batches)
Solubility
DMSO:50 mg/mL (157.15 mM)
Smiles
OC (=O) C1=C (OCC (F) (F) F) C=CC (OCC (F) (F) F) =C1
Molecular Formula
C11H8F6O4
Molecular Weight
318.17
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2,5-bis(2,2,2-trifluoroethoxy)benzoic Acid
CAS Number35480-52-5
PubChem CID2736078
IUPAC Name2,5-bis(2,2,2-trifluoroethoxy)benzoic acid
Molecular FormulaC11H8F6O4
Molecular Weight318.17
XLogP3.5
Topological Polar Surface Area55.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count5
Heavy Atom Count21
Formal Charge0
Complexity354
SMILES
C1=CC(=C(C=C1OCC(F)(F)F)C(=O)O)OCC(F)(F)F
InChI
InChI=1S/C11H8F6O4/c12-10(13,14)4-20-6-1-2-8(7(3-6)9(18)19)21-5-11(15,16)17/h1-3H,4-5H2,(H,18,19)
InChIKey
YPGYLCZBZKRYQJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,5-bis(2,2,2-trifluoroethoxy)benzoic Acid
CAS: 35480-52-5
CID: 2736078
Formula: C11H8F6O4
MW: 318.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight318.17
XLogP33.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count5
Exact Mass318.03267770
Monoisotopic Mass318.03267770
Topological Polar Surface Area55.8 Ų
Heavy Atom Count21
Formal Charge0
Complexity354
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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