3H-Indolium, 2-[2-[2-chloro-3-[2-[1,3-dihydro- 3,3-dimethyl-1-(4-sulfobutyl)-2H-indol-2- ylidene]ethylidene]-1-cyclohexen-1-yl]ethenyl]- 3,3-dimethyl-1-(4-sulfobutyl)-, inner salt, 97% CAS 162411-20-3
| CAS No. | 162411-20-3 |
| Molecular Formula | C38H47ClN2O6S2 |
| Molecular Weight | 727.37 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
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.
3H-Indolium, 2-[2-[2-chloro-3-[2-[1,3-dihydro- 3,3-dimethyl-1-(4-sulfobutyl)-2H-indol-2- ylidene]ethylidene]-1-cyclohexen-1-yl]ethenyl]- 3,3-dimethyl-1-(4-sulfobutyl)-, inner salt, 97% (CAS 162411-20-3), molecular formula C38H47ClN2O6S2 and molecular weight 727.37 g/mol, is a CATO reference standard with documented purity and traceability.
3H-Indolium, 2-[2-[2-chloro-3-[2-[1,3-dihydro- 3,3-dimethyl-1-(4-sulfobutyl)-2H-indol-2- ylidene]ethylidene]-1-cyclohexen-1-yl]ethenyl]- 3,3-dimethyl-1-(4-sulfobutyl)-, inner salt, 97% (C38H47ClN2O6S2) contains a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage, chlorine substitution. It is notably hygroscopic, halogen substitution raises its density and boiling point, the carboxyl group imparts weak acidity; these physicochemical properties determine the optimal preparation and storage of its standard solutions. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
CATO manufactures 3H-Indolium, 2-[2-[2-chloro-3-[2-[1,3-dihydro- 3,3-dimethyl-1-(4-sulfobutyl)-2H-indol-2- ylidene]ethylidene]-1-cyclohexen-1-yl]ethenyl]- 3,3-dimethyl-1-(4-sulfobutyl)-, inner salt, 97% 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 | C38H47ClN2O6S2 |
| Molecular Weight | 727.37 g/mol |
| Purity | 97%+ |
| Storage | Store in a cool place (≤25°C), protect from light, keep sealed and dry |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| 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) | 16.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2003 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 2 |
| Sulfur Atoms | 2 |
Related H Standards
- 3H-Indolium,2-[5-[1,3-dihydro-3,3-dimethyl-5-sulfo-1-(3-sulfopropyl)-2H-indol-2-ylidene]-1,3-pentadienyl]-3,3-dimethyl-5-sulfo-1-(3-sulfopropyl)-,inner salt, trisodiumsalt (CAS 190517-63-6)
- 3H-Indolium, 2-[2-[4-(diethylamino)phenyl]ethenyl]-1,3,3-trimethyl-, chloride (1:1) (CAS 6359-45-1)
- 3H-Indolium, 2-[2-[4-(diethylamino)phenyl]ethenyl]-1,3,3-trimethyl-, phosphate (1:1) (CAS 75535-16-9)
- 3H-Indolium, 2-[2-[4-[(2-cyanoethyl)ethylamino]-2-methylphenyl]ethenyl]-1,3,3-trimethyl-, phosphate (CAS 72208-20-9)
- 3H-Indolium, 2-[3-(1,3-dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)-1-propen-1-yl]-1,3,3-trimethyl-, chloride (1:1) (CAS 6320-14-5)
- 3H-Indolium,2-[2-[2-chloro-3-[(1,3-dihydro-1,3,3-trimethyl-5-sulfo-2H-indol-2-ylidene)ethylidene]-1-cyclohexen-1-yl]ethenyl]-1,3,3-trimethyl-5-sulfo-,inner salt, sodiumsalt (CAS 328064-20-6)
- 207399-07-3 3H-Indolium, 2-(2-(2-chloro-3-((1,3-dihydro-3,3-dimethyl-1-propyl-2H-indol-2-ylidene)ethylidene)-1-cyclohexen-1-yl)ethenyl)-3,3-dimethyl-1-propyl-, iodide 3H-Indolium, 2-(2-(2-chloro-3-(2-(1,3-dihydro-3,3-dimethyl-1-propyl-2H-indol-2-ylidene)ethylidene)-1-cyclohexen-1-yl)ethenyl)-3,3-dimethyl-1-propyl-, iodide (1:1) (CAS 207399-07-3)
- 207399-10-8 3H-Indolium, 2-[2-[3-[2-(1,3-dihydro-3,3-dimethyl-1-propyl-2H-indol-2-ylidene)ethylidene]-2-(phenylthio)-1-cyclohexen-1-yl]ethenyl]-3,3-dimethyl-1-propyl-, perchlorate (1:1) CTK0J9971 (CAS 207399-10-8)
Recommended Standards
- CAS 308805-39-2 (CAS 308805-39-2)
- 2,7-Diaminooctanedioate,palladium,2-pyridin-2-ylpyridine,dichloride (CAS 139280-50-5)
- ((Oxybis(ethane-2,1-diyl))bis(oxy))bis(ethane-2,1-diyl) distearate (CAS 142-20-1)
- Niobium(V) iodide (CAS 13779-92-5)
- N-(2-Methoxy-5-methylphenyl)-acetamide (CAS 6962-44-3)
- (Cyclopropylmethyl)(propan-2-yl)amine hydrochloride (CAS 1135288-48-0)
- Ethyl 2-mesitylacetate (CAS 5460-08-2)
- 4-[2-(Ethanesulfonyl)ethyl]piperidine hydrochloride (CAS 1864072-27-4)
- 2-(Benzylthio)-1-(2,4-dichloro-5-(2-methoxyethoxy)phenyl)-1H-imidazole (CAS 338967-20-7)
- 1-Oxo-2,3-dihydro-1H-pyrrolo[3,4-c]pyridine-6-carbaldehyde (CAS 2847886-20-6)
- [2-(4-Chlorophenyl)ethyl](3-methoxybenzyl)amine hydrobromide (CAS 1609403-84-0)
- Gefapixant Impurity 6 (CAS CATO-C4X-28496)
- (2S,4R)-tert-Butyl 4-(((benzyloxy)carbonyl)amino)-2-(hydroxymethyl)pyrrolidine-1-carboxylate (CAS 1194057-63-0)
- Semaglutide impurity 96 (CAS CATO-C4X-222696)
Why CATO?
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