3-(4-(n-(3-(Trifluoromethyl)phenyl)sulfamoyl)phenyl)acrylic acid CAS 379729-52-9
| CAS No. | 379729-52-9 |
| Molecular Formula | C16H12F3NO4S |
| Molecular Weight | 371.33 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Structurally, 3-(4-(n-(3-(Trifluoromethyl)phenyl)sulfamoyl)phenyl)acrylic acid (C16H12F3NO4S) contains a flavonoid core, an amide group, a sulfone group, a hydroxyl group, an ether linkage, fluorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 10.0, corresponding to approximately 10 ring(s) or double-bond equivalent(s). With a molecular weight of 371.33 g/mol, it falls into the moderately-high-molecular-weight range. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
3-(4-(n-(3-(Trifluoromethyl)phenyl)sulfamoyl)phenyl)acrylic acid (CAS 379729-52-9) is a high-purity analytical reference standard with the molecular formula C16H12F3NO4S and a molecular weight of 371.33 g/mol.
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.
As a certified reference material (CRM), 3-(4-(n-(3-(Trifluoromethyl)phenyl)sulfamoyl)phenyl)acrylic acid meets the metrological traceability requirements of ISO/IEC 17025 laboratories. Batch-to-batch consistency is monitored via control charts to guarantee comparable assigned values across lots.
Physical & Chemical Properties
| Molecular Formula | C16H12F3NO4S |
| Molecular Weight | 371.33 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep sealed and dry |
| Solubility (reference) | Soluble in methanol, acetonitrile, DMSO, water (slightly soluble) |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Contains ester bond; hydrolyzes under strong alkaline conditions |
| Degree of Unsaturation (DBE) | 10.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2025 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 1 |
| Sulfur Atoms | 1 |
Related n Standards
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- 8-Methyl-4-[3-(trifluoromethyl)benzoyl]-1-oxa-4-azaspiro[4.5]decane-3-carboxylic acid (CAS 1326814-31-6)
- N-(3-(trifluoromethyl)benzyl)-1,2-dihydronaphtho[2,1-b]furan-2-carboxamide (CAS 478078-37-4)
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Recommended Standards
- 1-(3-Fluorophenyl)-3-methyl-6-phenyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine (CAS 866142-70-3)
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- cis-N,N-Dibenzyl-tetrahydro-selenolo[3,4-d]imidazol-2(3H)-one (CAS 1346604-74-7)
- Sitagliptin Impurity 150 (CAS 945261-47-2)
- 1-(1-(But-2-yn-1-yl)-1H-pyrazol-4-yl)-N-methylmethanamine (CAS 1339261-06-1)
- 2-(1-((tert-Butoxycarbonyl)amino)cyclobutyl)acetic acid (CAS 249762-02-5)
- 2,3-Dihydroxypropyl 4-aminobenzoate (CAS 29593-08-6)
- 4-[(cyclopentyloxy)methyl]aniline (CAS 954256-12-3)
- 1-(4-Chlorophenethyl)-5-oxopyrrolidine-3-carboxylic acid (CAS 368870-06-8)
- 2-((2-((3-Chlorophenyl)amino)-2-oxoethyl)sulfonyl)acetic acid (CAS 344267-83-0)
- 2-Methyl-1-(m-tolylsulfonyl)piperazine hydrochloride (CAS 1353951-47-9)
- [1-(2-fluorophenyl)piperidin-4-yl]methanol (CAS 1005502-75-9)
- 5-(4-Methoxyphenyl)-1-pentene (CAS 51125-16-7)
- Hexapeptide-9 (CAS 885024-94-2)
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