3-(Benzo[d][1,3]dioxol-5-yl)-3-(2,5-dimethyl-3-(2,2,2-trifluoroacetyl)-1H-pyrrol-1-yl)propanoic acid CAS 866040-41-7
| CAS No. | 866040-41-7 |
| Molecular Formula | C18H16F3NO5 |
| Molecular Weight | 383.32 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Compared with other compounds in its class, the molecular weight of 383.32 g/mol gives 3-(Benzo[d][1,3]dioxol-5-yl)-3-(2,5-dimethyl-3-(2,2,2-trifluoroacetyl)-1H-pyrrol-1-yl)propanoic acid distinctive chromatographic separation conditions and mass-spectrometry parameter settings.
3-(Benzo[d][1,3]dioxol-5-yl)-3-(2,5-dimethyl-3-(2,2,2-trifluoroacetyl)-1H-pyrrol-1-yl)propanoic acid (CAS 866040-41-7) is a high-purity analytical reference standard with the molecular formula C18H16F3NO5 and a molecular weight of 383.32 g/mol.
Owing to a flavonoid core, an amide group, a hydroxyl group, an ether linkage, fluorine substitution, 3-(Benzo[d][1,3]dioxol-5-yl)-3-(2,5-dimethyl-3-(2,2,2-trifluoroacetyl)-1H-pyrrol-1-yl)propanoic acid is typically pale yellow to yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 383.32 g/mol — guide the selection of appropriate sample preparation and analytical techniques. The presence of an aromatic ring or conjugated system gives the compound characteristic absorption bands in the UV-Vis region, making it well suited to UV or diode-array detection (DAD).
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
CATO manufactures 3-(Benzo[d][1,3]dioxol-5-yl)-3-(2,5-dimethyl-3-(2,2,2-trifluoroacetyl)-1H-pyrrol-1-yl)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 | C18H16F3NO5 |
| Molecular Weight | 383.32 g/mol |
| Appearance | Pale yellow to 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, 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.) | 1987 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 1 |
Related Benzo Standards
- 1-(Benzo[d][1,3]dioxol-5-yl)-3-(4-(4-nitrophenyl)piperazin-1-yl)propan-1-one (CAS 477328-85-1)
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- N-(Benzo[d][1,3]dioxol-5-yl)-2-((4-ethyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide (CAS 557063-69-1)
- N-(3-(Benzo[d]oxazol-2-yl)phenyl)-5-bromofuran-2-carboxamide (CAS 328909-51-9)
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- N-(benzo[d][1,3]dioxol-5-yl)-1-(2-chlorobenzyl)-2-oxo-1,2-dihydropyridine-3-carboxamide (CAS 400077-83-0)
Recommended Standards
- 3-(Adamantan-1-yl)-4'-bromobiphenyl-4-ol (CAS 496868-80-5)
- 4-(2,5-Dichlorothiophen-3-yl)-2-{[(4-methoxyphenyl)methyl]sulfanyl}pyrimidine (CAS 338750-36-0)
- 2-{[(2,4-dichlorophenyl)methyl]sulfanyl}-5-[2-(methylsulfanyl)phenyl]-1,3,4-oxadiazole (CAS 338968-06-2)
- Ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((1,3-dioxoisoindolin-2-yl)methyl)-1H-1,2,3-triazole-4-carboxylate (CAS 311797-55-4)
- 2-(4-Methoxyphenyl)-N-(thiophen-3-ylmethyl)ethan-1-amine (CAS 899023-80-4)
- 1-((2,5-Dimethoxybenzyl)amino)propan-2-ol (CAS 861115-43-7)
- 5-(tert-Butyl) 2-methyl 1-methyl-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridine-2,5-dicarboxylate (CAS 2116240-24-3)
- 2,3,5-Tribromothiophene (CAS 3141-24-0)
- [1,3-Bis[2,6-bis[bis(4-methylphenyl)methyl]-4-methylphenyl]-1,3-dihydro-2H-imidazol-2-ylidene]hydroxygold-HF (CAS 1690356-94-5)
- Iopamidol Impurity 32 (CAS CATO-C4X-145032)
- 1-Chloroethyl Ethyl Carbonate (CAS 50893-36-2)
- 3-Bromo-5-fluoro-1-((2-(trimethylsilyl)ethoxy)methyl)-1H-pyrrolo[2,3-b]pyridine (CAS 2231676-28-9)
- (S)-3-(tert-Butyl)-4-(3,5-diisopropyl-2,6-dimethoxyphenyl)-2,3-dihydrobenzo[d][1,3]oxaphosphole (CAS 2444702-33-2)
- Peptide 438 (CAS CATO-CPTD788438)
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