N-(4-tert-Butylphenyl)-3-chloro-1-benzothiophene-2-carboxamide CAS 1004642-98-1
| CAS No. | 1004642-98-1 |
| Molecular Formula | C19H18ClNOS |
| Molecular Weight | 343.87 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Under current pharmacopoeial and regulatory frameworks, quality-control requirements for this class of reference material explicitly involve the control of targets including N-(4-tert-Butylphenyl)-3-chloro-1-benzothiophene-2-carboxamide.
N-(4-tert-Butylphenyl)-3-chloro-1-benzothiophene-2-carboxamide (CAS 1004642-98-1) is a high-purity analytical reference standard with the molecular formula C19H18ClNOS and a molecular weight of 343.87 g/mol.
N-(4-tert-Butylphenyl)-3-chloro-1-benzothiophene-2-carboxamide (C19H18ClNOS) contains a steroid core, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage, chlorine substitution. Halogen substitution raises its density and boiling point, its high carbon-to-hydrogen ratio confers good lipid solubility; 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.
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
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 | C19H18ClNOS |
| Molecular Weight | 343.87 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light |
| Solubility (reference) | Soluble in chloroform, dichloromethane, ethyl acetate, DMSO |
| 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.) | 1988 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 1 |
| Sulfur Atoms | 1 |
Recommended Standards
- SKF 83822 (CAS 74115-08-5)
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