Methyl 3-((4-phenyl-3,6-dihydropyridin-1(2H)-yl)sulfonyl)benzo[b]thiophene-2-carboxylate CAS 899977-55-0
| CAS No. | 899977-55-0 |
| Molecular Formula | C21H19NO4S2 |
| Molecular Weight | 413.51 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
Methyl 3-((4-phenyl-3,6-dihydropyridin-1(2H)-yl)sulfonyl)benzo[b]thiophene-2-carboxylate (CAS 899977-55-0), molecular formula C21H19NO4S2 and molecular weight 413.51 g/mol, is a CATO reference standard with documented purity and traceability.
Owing to a flavonoid core, an amide group, a sulfone group, a hydroxyl group, an ether linkage, Methyl 3-((4-phenyl-3,6-dihydropyridin-1(2H)-yl)sulfonyl)benzo[b]thiophene-2-carboxylate is typically pale yellow to yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 413.51 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).
CATO manufactures Methyl 3-((4-phenyl-3,6-dihydropyridin-1(2H)-yl)sulfonyl)benzo[b]thiophene-2-carboxylate 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 | C21H19NO4S2 |
| Molecular Weight | 413.51 g/mol |
| Purity | 97%+ |
| Storage | Store at room temperature, 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 |
| Degree of Unsaturation (DBE) | 13.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1987 |
| Nitrogen Atoms | 1 |
| Sulfur Atoms | 2 |
Recommended Standards
- Isopropyl 4-(3,4-dimethoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate (CAS 299449-79-9)
- N-({1'-benzyl-4',5'-dimethyl-1'H-[1,2'-bipyrrole]-3'-yl}methyl)-3-methoxybenzamide (CAS 478077-08-6)
- Isopropyl 4-(2,4-dimethoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate (CAS 299449-78-8)
- N-(2-((2-Amino-2-oxoethyl)thio)-4-phenylthiazol-5-yl)-2-phenoxypropanamide (CAS 946210-96-4)
- 6-Methylbenzofuran (CAS 17059-51-7)
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- 2-ethynyl-7-methyl-1,7-naphthyridin-8-one (CAS 2244482-10-6)
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- 1-(Ethoxymethyl)-3,5-dimethyl-1H-pyrazole (CAS 122606-07-9)
- Peptide WE-14 (CAS 115136-18-0)
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