3-(4-((6-(5-((3AS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamido)hexanoyl)oxy)phenyl)propanoic acid CAS 83592-10-3
| CAS No. | 83592-10-3 |
| Molecular Formula | C25H35N3O6S |
| Molecular Weight | 505.63 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
CATO supplies 3-(4-((6-(5-((3AS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamido)hexanoyl)oxy)phenyl)propanoic acid (CAS 83592-10-3), a certified reference material (molecular formula C25H35N3O6S, MW 505.63 g/mol) for analytical method development and quality control.
Based on its molecular formula C25H35N3O6S, 3-(4-((6-(5-((3AS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamido)hexanoyl)oxy)phenyl)propanoic 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 505.63 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.
The assigned purity is verified by mass-balance and quantitative NMR (qNMR) approaches, with the expanded uncertainty reported at a 95% confidence level (k=2). Batch homogeneity and stability are independently assessed for every lot.
Physical & Chemical Properties
| Molecular Formula | C25H35N3O6S |
| Molecular Weight | 505.63 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 |
| Degree of Unsaturation (DBE) | 10.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1980 |
| Nitrogen Atoms | 3 |
| Sulfur Atoms | 1 |
Recommended Standards
- 2-((2-(3,4-Dihydroquinolin-1(2H)-yl)-2-oxoethyl)thio)-6-(4-ethoxyphenyl)-4-phenylnicotinonitrile (CAS 332375-63-0)
- 756525-97-0 15-Biotinamino-4,7,10,13-tetraoxa-pentadecanoyl hydrazide MFCD09952658 (CAS 756525-97-0)
- 2-((2-(3,4-Dihydroquinolin-1(2H)-yl)-2-oxoethyl)thio)-4-(4-methoxyphenyl)-6-(p-tolyl)nicotinonitrile (CAS 337498-13-2)
- Tunodafil Impurity 11 (CAS CATO-C4X-311011)
- 3-(4-Chlorophenyl)-3-hydroxypropanenitrile (CAS 84466-38-6)
- 2-(((3-Nitropyridin-2-yl)thio)amino)acetic acid (CAS 77357-00-7)
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- Methyl 3-oxopiperazine-2-carboxylate (CAS 41817-92-9)
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- 3-[(4-Benzylphenoxy)methyl]pyrrolidinehydrochloride (CAS 1220016-68-1)
- Tau Peptide (245-274) (Repeat 1 Domain) trifluoroacetate salt (CAS 1428134-39-7)
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