(S)-3-(4-Iodophenyl)-2-(2,2,2-trifluoroacetamido)propanoic acid CAS 115820-04-7
| CAS No. | 115820-04-7 |
| Molecular Formula | C11H9F3INO3 |
| Molecular Weight | 387.09 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The occurrence of (S)-3-(4-Iodophenyl)-2-(2,2,2-trifluoroacetamido)propanoic acid is closely related to a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine/iodine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.
CATO supplies (S)-3-(4-Iodophenyl)-2-(2,2,2-trifluoroacetamido)propanoic acid (CAS 115820-04-7), a certified reference material (molecular formula C11H9F3INO3, MW 387.09 g/mol) for analytical method development and quality control.
Structurally, (S)-3-(4-Iodophenyl)-2-(2,2,2-trifluoroacetamido)propanoic acid (C11H9F3INO3) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine/iodine substitution. The molecule exhibits a degree of unsaturation (DBE) of 6.0, corresponding to approximately 6 ring(s) or double-bond equivalent(s). With a molecular weight of 387.09 g/mol, it falls into the moderately-high-molecular-weight range. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
This reference standard is suitable for quantitative analysis on major chromatographic platforms including HPLC, GC, LC-MS/MS, and GC-MS, serving as an external calibration standard or a system suitability test reference material.
CATO manufactures (S)-3-(4-Iodophenyl)-2-(2,2,2-trifluoroacetamido)propanoic acid under ISO 17034:2016 accreditation with dual CNAS and ANAB accreditation. Each batch is characterized by orthogonal methods and supplied with a full Certificate of Analysis (COA), ensuring metrological traceability.
Physical & Chemical Properties
| Molecular Formula | C11H9F3INO3 |
| Molecular Weight | 387.09 g/mol |
| Appearance | Off-white to pale yellow crystalline powder. (slight halide-like odor, low volatility) |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep sealed and dry |
| Solubility (reference) | Soluble in methanol, ethanol, DMSO |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening; Contains ester bond; hydrolyzes under strong alkaline conditions |
| Degree of Unsaturation (DBE) | 6.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1990 |
| Halogen Content | F/I-containing |
| Nitrogen Atoms | 1 |
Related S Standards
- 3-(2-Iodophenyl)-1-(naphthalen-2-yl)propan-1-one (CAS 320576-29-2)
- 1-(4-Iodophenyl)-3-morpholinopyrrolidine-2,5-dione (CAS 306732-13-8)
- 2-(4-Iodophenyl)-7-(trifluoromethyl)imidazo[1,2-a]pyridine (CAS 944580-94-3)
- (4-Iodophenyl)diphenylphosphane (CAS 440111-10-4)
- 1-Boc-4-(4-Iodophenyl)piperazine (CAS 151978-66-4)
- Ethyl 8-(2-iodophenyl)-8-oxooctanoate (CAS 898777-21-4)
- Ethyl 8-(3-iodophenyl)-8-oxooctanoate (CAS 898777-36-1)
- Ethyl 8-(4-iodophenyl)-8-oxooctanoate (CAS 898777-48-5)
Recommended Standards
- 2,5-Dibromo-n-(1-methoxypropan-2-yl)benzenesulfonamide (CAS 1008970-31-7)
- Methyl 5-iodo-3-methyl-2-(2,2,2-trifluoroacetamido)benzoate (CAS 1186405-10-6)
- Tetracosanoyl Chloride (CAS 58576-73-1)
- Ethyl 3-iodo-4-(2,2,2-trifluoroacetamido)benzoate (CAS 183989-83-5)
- 2-Chloro-5-methoxy-3H-imidazo[4,5-b]pyridine (CAS 1260672-20-5)
- 1-(Hydroxymethyl)-N-methylcyclopropanecarboxamide (CAS 1610043-76-9)
- 4-Bromo-1-fluoro-2-((2-methoxyethoxy)methyl)benzene (CAS 188723-93-5)
- Methyl 4-[(2-chloro-1,3-thiazol-5-yl)methoxy]-benzenecarboxylate (CAS 339105-21-4)
- N-(2-Methoxyethyl)-N-(2-nitrophenyl)methanesulfonamide (CAS 1845706-34-4)
- 5-Methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)nicotinonitrile (CAS 1310384-33-8)
- 4-(2-Benzylphenoxy)-3-methylaniline (CAS 946698-65-3)
- 4-Chloro-6,7-dihydro-5H-cyclopentapyrimidine (CAS 83942-13-6)
- 5-Ethoxy-2-ethyl-1H-benzo[d]imidazole (CAS 192326-08-2)
- Liraglutide Impurity 18 TFA Salt (CAS CATO-C4X-199218)
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