1-Difluoromethylsulfanyl-4-isothiocyanato-benzene CAS 189281-93-4
| CAS No. | 189281-93-4 |
| Molecular Formula | C8H5F2NS2 |
| Molecular Weight | 217.26 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The molecular framework of 1-Difluoromethylsulfanyl-4-isothiocyanato-benzene (C8H5F2NS2) is characterized by a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, fluorine substitution. In reversed-phase chromatography, its retention is governed primarily by the protonation state of its nitrogen-containing groups, which provides a practical basis for HPLC-UV/DAD or LC-MS method development. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
1-Difluoromethylsulfanyl-4-isothiocyanato-benzene (CAS 189281-93-4), molecular formula C8H5F2NS2 and molecular weight 217.26 g/mol, is a CATO reference standard with documented purity and traceability.
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.
As a certified reference material (CRM), 1-Difluoromethylsulfanyl-4-isothiocyanato-benzene 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 | C8H5F2NS2 |
| Molecular Weight | 217.26 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep tightly closed to prevent evaporation |
| Solubility (reference) | Soluble in methanol, acetonitrile, DMSO |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 6.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2011 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 1 |
| Sulfur Atoms | 2 |
Related Difluoromethylsulfanyl Standards
Recommended Standards
- tert-butyl N-[2-(2-oxopropoxy)ethyl]carbamate (CAS 1864063-87-5)
- 1-(1,2,3,4-Tetrahydroquinolin-6-yl)cyclopropane-1-carboxylic acid (CAS 1895366-23-0)
- (3R,4R)-1-Boc-4-methoxypyrrolidin-3-ol (CAS 1864003-19-9)
- 4-O-Tetrahydropyranyl-4-hydroxyphenylacetonitrile (CAS 19001-09-3)
- (S)-2-((tert-butoxycarbonyl)amino)-2-(naphthalen-1-yl)acetic acid (CAS 146621-93-4)
- (2,5-Difluorobenzyl)(methyl)sulfane (CAS 1443305-01-8)
- 2,3,4,9-tetrahydrocarbazol-1-one (CAS 3456-99-3)
- 5-Difluoromethoxy-2-fluoro-3-formylpyridine (CAS 1806275-28-4)
- 2-(DIFLUOROMETHYL)-3-FLUOROISONICOTINIC ACID (CAS 1379375-22-0)
- 7-Chloro-4-(phenylsulfonyl)-3,4-dihydro-2H-benzo[b][1,4]thiazine (CAS 338778-00-0)
- [Mes-Acr-Ph]+(Cl)- (CAS 2088856-21-5)
- 4-Chloro-6-fluoro-8-methoxyquinazoline (CAS 1565090-05-2)
- 5-Bromo-4-chloro-1H-benzo[d]imidazol-2(3H)-one (CAS 1388050-02-9)
- Tau Peptide (306-317) trifluoroacetate salt (CAS 1003007-59-7)
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