1-(4-Methoxyphenyl)-2-thiocyanatoethanone CAS 6097-26-3
| CAS No. | 6097-26-3 |
| Molecular Formula | C10H9NO2S |
| Molecular Weight | 207.25 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
1-(4-Methoxyphenyl)-2-thiocyanatoethanone (CAS 6097-26-3), molecular formula C10H9NO2S and molecular weight 207.25 g/mol, is a CATO reference standard with documented purity and traceability.
Structurally, 1-(4-Methoxyphenyl)-2-thiocyanatoethanone (C10H9NO2S) contains a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, 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 207.25 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.
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 | C10H9NO2S |
| Molecular Weight | 207.25 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) | 7.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1958 |
| Nitrogen Atoms | 1 |
| Sulfur Atoms | 1 |
Related Methoxyphenyl Standards
- 5-(4-Methoxyphenyl)-1,3,4-thiadiazol-2-amine (CAS 1014-25-1)
- 5-(4-Methoxyphenyl)-1,2,4-thiadiazol-3-amine (CAS 1086385-64-9)
- 4-(2-methoxyphenyl)-2,3-dihydro-1,3-thiazol-2-one (CAS 1095110-49-8)
- 3-(3-Methoxyphenyl)-1,2,4-thiadiazol-5-amine (CAS 1153133-35-7)
- 4-(4-Methoxyphenyl)-1,2,3-thiadiazol-5-amine (CAS 115842-95-0)
- 4-(3-methoxyphenyl)-2,3-dihydro-1,3-thiazol-2-one (CAS 116269-85-3)
- 3-(4-methoxyphenyl)-1,2,4-thiadiazol-5-amine (CAS 138588-25-7)
- 3-(4-Methoxyphenyl)-1h-1,2,4-triazole-5-thiol (CAS 33901-36-9)
Recommended Standards
- 1-([1,2,4]triazolo[4,3-a]pyridin-3-ylthio)propan-2-one (CAS 442865-39-6)
- 1-(6-Amino-2-methylthiazolo[5,4-b]pyridin-7-yl)ethan-1-one (CAS 2178985-13-0)
- (Z)-N'-hydroxy-2-(1H-pyrrol-1-yl)thiophene-3-carboximidamide (CAS 866041-04-5)
- 1-(6-Methoxybenzo[d]thiazol-2-yl)ethanone (CAS 65840-58-6)
- n-(3-Cyanophenyl)-3-(1h-imidazol-1-yl)propanamide (CAS 793679-39-7)
- 5,7,8,9-Tetrahydro-6H-pyrido[3,2-b]azepin-6-one (CAS 61479-36-5)
- 3-methanesulfonyl-1H,4H,5H,6H,7H-pyrazolo[3,4-d]pyrimidine-4,6-dione (CAS 130224-64-5)
- 4-(((1-Phenyl-1H-pyrrol-2-yl)methylene)amino)phenol (CAS 593272-60-7)
- Gonadorelin impurity 1 (CAS CATO-C4X-23541)
- N-(2-Cyano-3-methylbutan-2-yl)-2-((5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)thio)acetamide (CAS 847840-90-8)
- 5-methyl-1-(2-methyl-1,2,3,4-tetrahydroisoquinolin-5-yl)-1H-1,2,3-triazole-4-carboxylic acid hydrochloride (CAS 1306603-95-1)
- 5-Nitro-1,3-dihydrobenzo[de]isochromene-6-carbonitrile (CAS 959766-44-0)
- 1-(4-Aminopiperidin-1-yl)-2-(thiophen-2-yl)ethan-1-one (CAS 1018661-78-3)
- (Gly1,Ser3·22,Gln?·3?,Thr?,Arg1?,Tyr21,Ala23·31,Aib32)-Pancreatic Polypeptide (human) (CAS 313988-89-5)
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