(3Z)-3-[(Dimethylamino)methylidene]-1,3-dihydro-2-benzothiophen-1-one CAS 338410-40-5
| CAS No. | 338410-40-5 |
| Molecular Formula | C11H11NOS |
| Molecular Weight | 205.28 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The occurrence of (3Z)-3-[(Dimethylamino)methylidene]-1,3-dihydro-2-benzothiophen-1-one is closely related to a nitrogen-containing heterocyclic scaffold, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.
(3Z)-3-[(Dimethylamino)methylidene]-1,3-dihydro-2-benzothiophen-1-one (CAS 338410-40-5), molecular formula C11H11NOS and molecular weight 205.28 g/mol, is a CATO reference standard with documented purity and traceability.
Structurally, (3Z)-3-[(Dimethylamino)methylidene]-1,3-dihydro-2-benzothiophen-1-one (C11H11NOS) contains a nitrogen-containing heterocyclic scaffold, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage. The molecule exhibits a degree of unsaturation (DBE) of 7.0, corresponding to approximately 7 ring(s) or double-bond equivalent(s). With a molecular weight of 205.28 g/mol, it falls into the medium-molecular-weight range. 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 | C11H11NOS |
| Molecular Weight | 205.28 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light |
| Solubility (reference) | Soluble in chloroform, dichloromethane, ethyl acetate, DMSO |
| Stability | Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 7.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2025 |
| Nitrogen Atoms | 1 |
| Sulfur Atoms | 1 |
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