2-[(4-Methylphenyl)sulfanyl]-5-(trifluoromethyl)benzenecarbonitrile CAS 477867-12-2
| CAS No. | 477867-12-2 |
| Molecular Formula | C15H10F3NS |
| Molecular Weight | 293.31 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The occurrence of 2-[(4-Methylphenyl)sulfanyl]-5-(trifluoromethyl)benzenecarbonitrile is closely related to a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, fluorine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.
CATO supplies 2-[(4-Methylphenyl)sulfanyl]-5-(trifluoromethyl)benzenecarbonitrile (CAS 477867-12-2), a certified reference material (molecular formula C15H10F3NS, MW 293.31 g/mol) for analytical method development and quality control.
Structurally, 2-[(4-Methylphenyl)sulfanyl]-5-(trifluoromethyl)benzenecarbonitrile (C15H10F3NS) contains a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, fluorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 10.0, corresponding to approximately 10 ring(s) or double-bond equivalent(s). With a molecular weight of 293.31 g/mol, it falls into the medium-molecular-weight range. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
CATO manufactures 2-[(4-Methylphenyl)sulfanyl]-5-(trifluoromethyl)benzenecarbonitrile under ISO 17034:2016 accreditation with dual CNAS and ANAB accreditation. Each batch is characterized by orthogonal methods and supplied with a full Certificate of Analysis (COA), ensuring metrological traceability.
Physical & Chemical Properties
| Molecular Formula | C15H10F3NS |
| Molecular Weight | 293.31 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep tightly closed to prevent evaporation |
| Solubility (reference) | Soluble in chloroform, dichloromethane, ethyl acetate |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 10.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2025 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 1 |
| Sulfur Atoms | 1 |
Related Methylphenyl Standards
- 2-[(2-Methylphenyl)sulfanyl]-5-(trifluoromethyl)benzenecarbonitrile (CAS 477866-93-6)
- 8-[3-(4-Methylphenyl)-1,2,4-oxadiazol-5-yl]-2H,3H-[1,2,4]triazolo[4,3-a]pyridin-3-one (CAS 1239776-62-5)
- 8-[3-(3-Methylphenyl)-1,2,4-oxadiazol-5-yl]-2H,3H-[1,2,4]triazolo[4,3-a]pyridin-3-one (CAS 1239848-75-9)
- 2-[(5Z)-5-[(4-Methylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid (CAS 82158-68-7)
- Bis(4-methylphenyl)-1,2,4-triazine-3-thiol (CAS 63031-39-0)
- Methyl 3-(3-methylphenyl)-5-(trifluoromethyl)benzoate (CAS 1820666-87-2)
- N-(4-Methylphenyl)-1-(6-methylpyridin-2-yl)-1H-imidazole-4-carboxamide (CAS 477864-36-1)
- 1-Benzyl-3-(4-methylphenyl)-1h-pyrazole-4-carboxylic acid (CAS 956453-12-6)
Recommended Standards
- 4-(2-(Trifluoromethyl)benzyl)thiomorpholine 1,1-dioxide (CAS 477864-27-0)
- 2-((4-Fluorophenyl)amino)-2-oxoethyl 3-methylthiophene-2-carboxylate (CAS 387854-15-1)
- 4-(3-(Trifluoromethyl)benzyl)thiomorpholine 1,1-dioxide (CAS 478040-90-3)
- 2-((2-Fluorophenyl)amino)-2-oxoethyl 3-methylthiophene-2-carboxylate (CAS 479717-93-6)
- (S)-Phenyl(p-tolyl)methanol (CAS 24218-12-0)
- N-[3-(Dimethylamino)propyl]lauramide HCl (CAS 71732-95-1)
- 1-(3-Bromo-5-fluorophenyl)prop-2-en-1-amine (CAS 1270372-08-1)
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- 2-chloro-7-(p-tolylsulfonyl)pyrrolo[2,3-d]pyrimidine (CAS 1694666-73-3)
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