5-[(3,4-Dimethoxyphenyl)methyl]-2-[4-[4-[5-[(3,4-dimethoxyphenyl)methyl]-3-phenyltetrazol-2-ium-2-yl]-3-methoxyphenyl]-2-methoxyphenyl]-3-phenyltetrazol-2-ium Dichloride CAS 106629-90-7
| CAS No. | 106629-90-7 |
| Molecular Formula | C46H44N8O6 |
| Molecular Weight | N/A |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The occurrence of 5-[(3,4-Dimethoxyphenyl)methyl]-2-[4-[4-[5-[(3,4-dimethoxyphenyl)methyl]-3-phenyltetrazol-2-ium-2-yl]-3-methoxyphenyl]-2-methoxyphenyl]-3-phenyltetrazol-2-ium Dichloride is closely related to a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, chlorine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.
5-[(3,4-Dimethoxyphenyl)methyl]-2-[4-[4-[5-[(3,4-dimethoxyphenyl)methyl]-3-phenyltetrazol-2-ium-2-yl]-3-methoxyphenyl]-2-methoxyphenyl]-3-phenyltetrazol-2-ium Dichloride (CAS 106629-90-7), molecular formula C46H44N8O6Cl and molecular weight 840.36 g/mol, is a CATO reference standard with documented purity and traceability.
Structurally, 5-[(3,4-Dimethoxyphenyl)methyl]-2-[4-[4-[5-[(3,4-dimethoxyphenyl)methyl]-3-phenyltetrazol-2-ium-2-yl]-3-methoxyphenyl]-2-methoxyphenyl]-3-phenyltetrazol-2-ium Dichloride (C46H44N8O6Cl) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, chlorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 28.5, corresponding to approximately 28 ring(s) or double-bond equivalent(s). With a molecular weight of 840.36 g/mol, it falls into the high-molecular-weight range. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
As a certified reference material (CRM), 5-[(3,4-Dimethoxyphenyl)methyl]-2-[4-[4-[5-[(3,4-dimethoxyphenyl)methyl]-3-phenyltetrazol-2-ium-2-yl]-3-methoxyphenyl]-2-methoxyphenyl]-3-phenyltetrazol-2-ium Dichloride 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 | C46H44N8O6 2*Cl |
| Molecular Weight | 840.36 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) | 28.5 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1987 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 8 |
Related Dimethoxyphenyl Standards
- [(2,3-dimethoxyphenyl)methyl](ethyl)amine (CAS 100054-84-0)
- 5-(3,5-Dimethoxyphenyl)-3-oxopentanenitrile (CAS 1000895-54-4)
- 6-(3,5-Dimethoxyphenyl)-3-(4-fluorophenyl)-1H-pyrazolo[3,4-b]pyridine (CAS 1001083-74-4)
- 3-(2,5-Dimethoxyphenyl)propanoyl chloride (CAS 100126-94-1)
- 2-(3,5-Dimethoxyphenyl)morpholine (CAS 1001940-37-9)
- (2E)-1-(2,4-Dimethoxyphenyl)-3-[4-(propan-2-yl)phenyl]prop-2-en-1-one (CAS 1002460-32-3)
- (2E)-1-(2,4-Dimethoxyphenyl)-3-(5-methylthiophen-2-yl)prop-2-en-1-one (CAS 1002460-75-4)
- 1-(3,4-Dimethoxyphenyl)butan-1-amine hydrochloride (CAS 100252-51-5)
Recommended Standards
- 4,5-Bis-(di-i-propylphosphinomethyl)acridine (CAS 1101230-28-7)
- 3-Hydroxy-2-methyl-4-nitropyridine (CAS 15128-83-3)
- 2-((tert-Butoxycarbonyl)amino)-4-chloro-6-fluorobenzoic acid (CAS 2137590-71-5)
- N-(adamantan-1-yl)-3-amino-6-(3,4-dimethoxyphenyl)-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide (CAS 625369-55-3)
- 2-((2,5-Dichlorobenzyl)(ethyl)amino)ethanol (CAS 1353975-37-7)
- Diethyl (3-(trifluoromethyl)benzyl)phosphonate (CAS 146780-08-7)
- 4-(Benzyloxy)-3-methoxy-benzyl Alcohol-d2 (CAS 74719-60-1)
- 1-(trifluoromethyl)cyclopropanecarbaldehyde (CAS 1229311-61-8)
- 6-Chloro-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole hydrochloride (CAS 1135207-74-7)
- Ginseng Tetrapeptide (CAS 178553-95-2)
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