2-iodo-4-(methylsulfanyl)benzonitrile CAS 54558-83-7
| CAS No. | 54558-83-7 |
| Molecular Formula | C8H6INS |
| Molecular Weight | 275.11 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 2-iodo-4-(methylsulfanyl)benzonitrile.
2-iodo-4-(methylsulfanyl)benzonitrile (CAS 54558-83-7) is a high-purity analytical reference standard with the molecular formula C8H6INS and a molecular weight of 275.11 g/mol.
Structurally, 2-iodo-4-(methylsulfanyl)benzonitrile (C8H6INS) contains a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, iodine substitution. The molecule exhibits a degree of unsaturation (DBE) of 6.0, corresponding to approximately 6 ring(s) or double-bond equivalent(s). With a molecular weight of 275.11 g/mol, it falls into the medium-molecular-weight range. The aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).
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 | C8H6INS |
| Molecular Weight | 275.11 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.) | 1972 |
| Halogen Content | I-containing |
| Nitrogen Atoms | 1 |
| Sulfur Atoms | 1 |
Related iodo Standards
- 2-Iodo-4-methylbenzo[d]thiazole (CAS 1175277-60-7)
- 2-Iodo-5-methylbenzo[d]thiazole (CAS 1175278-10-0)
- 7-Iodo-2-methylbenzothiazole (CAS 1261632-37-4)
- 4-Iodo-2-methylbenzothiazole (CAS 1261740-11-7)
- 2-iodo-5-(methylsulfanyl)benzonitrile (CAS 127049-97-2)
- 2-Iodo-6-methylbenzo[d]thiazole (CAS 3622-21-7)
- 5-Iodo-2-methylbenzo[d]thiazole (CAS 90414-61-2)
- 6-Iodo-2-methyl-1,3-benzothiazole (CAS 68867-20-9)
Recommended Standards
- 2-(4-Bromo-3-fluorophenoxy)tetrahydro-2H-pyran (CAS 485832-11-9)
- 1-Bromo-2-cyclopropyl-3-fluoro-5-(methoxymethoxy)benzene (CAS 2883770-94-1)
- 3-Bromo-2-butoxy-6-fluorobenzaldehyde (CAS 2379322-49-1)
- 1-(tert-Butoxycarbonyl)-3-methyl-1H-indole-2-boronic acid (CAS 352359-20-7)
- 3,5-Dibromo-4-(chlorosulfonyl)benzoic acid (CAS 1375474-74-0)
- 4-Bromobutyl Acetate (CAS 4753-59-7)
- (S)-5-Chloro-1,2,3,4-tetrahydronaphthalen-1-amine hydrochloride (CAS 2055848-92-3)
- Vitamin A Impurity 22 (CAS 56013-05-9)
- 2-chloro-N-methoxyacetamide (CAS 36851-81-7)
- 1-(2-Methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)piperidine-4-carboxylic acid (CAS 1707594-65-7)
- 2-(isopropylamino)-6-(trifluoromethyl)pyrimidin-4(1H)-one (CAS 339011-06-2)
- 1-Benzyl-4-bromo-3,5-dimethyl-1H-pyrazole Hydrochloride (CAS 2103396-94-5)
- ((1aS,6aS)-4-Methylenehexahydrocyclopropa[b]pyrrolizin-5a(3H)-yl)methanol (CAS 2856022-73-4)
- Casein Kinase II Receptor Peptide (CAS 198481-81-1)
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