diphenyl (1-{[(3-chloro-4-fluoroanilino)carbothioyl]amino}ethyl)phosphonate CAS 680214-47-5
| CAS No. | 680214-47-5 |
| Molecular Formula | C21H19ClFN2O3PS |
| Molecular Weight | 464.88 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
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.
diphenyl (1-{[(3-chloro-4-fluoroanilino)carbothioyl]amino}ethyl)phosphonate (CAS 680214-47-5), molecular formula C21H19ClFN2O3PS and molecular weight 464.88 g/mol, is a CATO reference standard with documented purity and traceability.
Structurally, diphenyl (1-{[(3-chloro-4-fluoroanilino)carbothioyl]amino}ethyl)phosphonate (C21H19ClFN2O3PS) contains a steroid core, an amide group, a sulfone group, a phosphonate group, a hydroxyl group, an ether linkage, fluorine/chlorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 12.5, corresponding to approximately 12 ring(s) or double-bond equivalent(s). With a molecular weight of 464.88 g/mol, it falls into the moderately-high-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.
As a certified reference material (CRM), diphenyl (1-{[(3-chloro-4-fluoroanilino)carbothioyl]amino}ethyl)phosphonate 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 | C21H19ClFN2O3PS |
| Molecular Weight | 464.88 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) | 12.5 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1985 |
| Halogen Content | F/Cl-containing |
| Nitrogen Atoms | 2 |
| Sulfur Atoms | 1 |
Related diphenyl Standards
- Diphenyl(2',4',6'-triisopropylbiphenyl-2-yl)phosphine (CAS 819867-23-7)
- 2-(2,2-Diphenyl-1,3-benzodioxol-5-yl)-3,5,7-trihydroxy-4H-1-benzopyran-4-one (CAS 357194-03-7)
- 4,5-Diphenyl-1-trityl-1H-imidazole (CAS 31635-59-3)
- 5-((1,3-Diphenyl-1H-pyrazol-4-yl)methylene)-3-(4-methylbenzyl)-2-thioxothiazolidin-4-one (CAS 624723-11-1)
- Diphenyl(2-(2-(trimethylsilyl)naphthalen-1-yl)phenyl)phosphane (CAS 2227375-33-7)
- Diphenyl (((4-nitrophenyl)amino)(phenyl)methyl)phosphonate (CAS 19348-89-1)
- 2-[(2,4-Diphenyl-1,3-thiazol-5-yl)methyl]-5-{[(4-fluorophenyl)methyl]sulfanyl}-1,3,4-oxadiazole (CAS 338750-02-0)
- 5',6'-Diphenyl-[1,1':2',1''-terphenyl]-3',4'-dicarboxylic acid (CAS 27873-89-8)
Recommended Standards
- (2E)-3-(2-Chloro-5-nitrophenyl)-2-{4-[2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)ethyl]-1,3-thiazol-2-yl}prop-2-enenitrile (CAS 866050-90-0)
- Rivaroxaban Impurity 202 (CAS CATO-C4X-1090202)
- 4-((2-Chlorothiazol-5-yl)methoxy)-N-(4-(trifluoromethoxy)phenyl)benzenesulfonamide (CAS 866136-48-3)
- Rivaroxaban Impurity 203 (CAS CATO-C4X-1090203)
- (2S,4R)-4-(3-Cyanobenzyl)pyrrolidine-2-carboxylic acid (CAS 1049981-82-9)
- [(2E)-2-Methyl-3-phenylprop-2-en-1-yl](2-methylpropyl)amine hydrochloride (CAS 1240590-83-3)
- Amoxapine RC 9 (CAS 47439-36-1)
- (E)-2-ethyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-en-1-ol (CAS 106185-75-5)
- 4-chloro-3-methylquinolin-5-amine (CAS 2031268-87-6)
- 5-Methyl-2,3-dihydro-1h-inden-4-ol (CAS 20294-31-9)
- (3AR,5S,6R,6aR)-5-((R)-2,2-dimethyl-1,3-dioxolan-4-yl)-6-methoxy-2,2-dimethyltetrahydrofuro[2,3-d][1,3]dioxole (CAS 29587-01-7)
- 3-(3,4-Dimethoxyphenyl)-4,7-dihydroxy-2H-chromen-2-one (CAS 929339-03-7)
- Baclofen impurity 19 (CAS 940-62-5)
- Semaglutide impurity 81 (CAS CATO-C4X-222681)
Why CATO?
- ISO 17034 accredited reference material producer (CNAS + ANAB dual accreditation)
- 130,000+ catalog items in stock, COA supplied with every batch
- Worldwide shipping with full export documentation (HS code guidance available)
- Technical support: +86 18665070610 / Nicole.chen@cato-chem.com