2-({[(1,3-dioxaindan-5-yl)carbamoyl]methyl}sulfanyl)benzoic acid CAS 793679-41-1
| CAS No. | 793679-41-1 |
| Molecular Formula | C16H13NO5S |
| Molecular Weight | 331.34 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
2-({[(1,3-dioxaindan-5-yl)carbamoyl]methyl}sulfanyl)benzoic acid (CAS 793679-41-1), molecular formula C16H13NO5S and molecular weight 331.34 g/mol, is a CATO reference standard with documented purity and traceability.
Based on its molecular formula C16H13NO5S, 2-({[(1,3-dioxaindan-5-yl)carbamoyl]methyl}sulfanyl)benzoic acid contains a flavonoid core, an amide group, a sulfone group, a hydroxyl group, an ether linkage; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 331.34 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. 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 2-({[(1,3-dioxaindan-5-yl)carbamoyl]methyl}sulfanyl)benzoic 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 | C16H13NO5S |
| Molecular Weight | 331.34 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 |
| Degree of Unsaturation (DBE) | 11.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1986 |
| Nitrogen Atoms | 1 |
| Sulfur Atoms | 1 |
Related dioxaindan Standards
- 2-({[(1,3-dioxaindan-5-yl)carbamoyl]methyl}sulfanyl)pyridine-3-carboxylic acid (CAS 460736-32-7)
- 3-{[(1,3-dioxaindan-5-yl)methyl]sulfamoyl}benzoic acid (CAS 722473-64-5)
- 7-(1,3-Dioxaindan-5-yl)-1-methyl-2,4-dioxo-1h,2h,3h,4h-pyrido[2,3-d]pyrimidine-5-carboxylic acid (CAS 879303-83-0)
- 1-{[1-(1,3-dioxaindan-5-yl)ethylidene]amino}-3-(oxolan-2-ylmethyl)thiourea (CAS 571925-98-9)
- 3-[(1,3-dioxaindan-5-yl)sulfamoyl]benzoic acid (CAS 775310-75-3)
- 4-(1,3-Dioxaindan-5-yl)-3-(5-chlorothiophen-2-yl)-1h-pyrazol-5-amine (CAS 1488411-01-3)
- n-(1,3-Dioxaindan-5-yl)-2-chloro-3-oxo-3-phenylpropanamide (CAS 848316-27-8)
- 4-(1,3-Dioxaindan-5-yl)-3-(5-bromofuran-2-yl)-1h-pyrazol-5-amine (CAS 1312440-51-9)
Recommended Standards
- 1-Amino-N-(2-fluoro-4-methoxyphenyl)-4-oxo-1,4,5,6,7,8-hexahydrocyclohepta[b]pyrrole-3-carboxamide (CAS 380365-95-7)
- 2-({[(3,4-dimethoxyphenyl)methyl]carbamoyl}methanesulfonyl)acetic acid (CAS 338793-98-9)
- 1-[(2,4-dimethoxyphenyl)methyl]-7-fluoro-indoline-2-carboxylicacid (CAS 2306263-84-1)
- 2-(4-Fluorophenyl)-N-(5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl)acetamide (CAS 476463-39-5)
- N-(4-Chlorophenyl)-4-(6-chloro-2-pyridinyl)tetrahydro-1(2H)-pyrazinecarboxamide (CAS 339107-26-5)
- Methylsynephrine (CAS 365-26-4)
- (S)-2-(1-methylpiperidin-3-yl)ethan-1-ol (CAS 1620510-56-6)
- Methyl (2Z)-2-[(dimethylamino)methylidene]-4,4-dimethyl-3-oxopentanoate (CAS 154934-91-5)
- Heptyl 6-bromo-2-(4-methoxyphenyl)quinoline-4-carboxylate (CAS 355421-30-6)
- tert-Butyl 4-(((benzyloxy)carbonyl)amino)-4-carbamoylpiperidine-1-carboxylate (CAS 288154-17-6)
- 3-fluoro-2-iodopyridine-4-carbonitrile (CAS 1807159-58-5)
- 1-(2-Chlorophenyl)piperazine monohydrochloride (CAS 41202-32-8)
- [3-(methoxy-d3)phenyl]methanol (CAS 1332363-08-2)
- Semaglutide impurity 229 (CAS CATO-C4X-2226229)
Why CATO?
- ISO 17034 accredited reference material producer (CNAS + ANAB dual accreditation)
- 130,000+ catalog items in stock, COA supplied with every batch
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