3-{[(4-tert-butylphenyl)methyl]sulfanyl}-1-phenyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile CAS 439096-57-8
| CAS No. | 439096-57-8 |
| Molecular Formula | C27H28N2S |
| Molecular Weight | 412.59 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
CATO manufactures 3-{[(4-tert-butylphenyl)methyl]sulfanyl}-1-phenyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile 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.
3-{[(4-tert-butylphenyl)methyl]sulfanyl}-1-phenyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile (CAS 439096-57-8), molecular formula C27H28N2S and molecular weight 412.59 g/mol, is a CATO reference standard with documented purity and traceability.
Based on its molecular formula C27H28N2S, 3-{[(4-tert-butylphenyl)methyl]sulfanyl}-1-phenyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile contains a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 412.59 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. The presence of an aromatic ring or conjugated system gives the compound characteristic absorption bands in the UV-Vis region, making it well suited to UV or diode-array detection (DAD).
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
Physical & Chemical Properties
| Molecular Formula | C27H28N2S |
| Molecular Weight | 412.59 g/mol |
| Purity | 97%+ |
| Storage | Store at room temperature, protect from light |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 15.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2025 |
| Nitrogen Atoms | 2 |
| Sulfur Atoms | 1 |
Related tert Standards
- 2-{[(4-tert-butylphenyl)methyl]sulfanyl}-1-methyl-4,5-diphenyl-1H-imidazole (CAS 339277-18-8)
- 2-{[5-(4-tert-Butylphenyl)-4-(4-methoxyphenyl)-4h-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide (CAS 893726-65-3)
- 3-[(4-tert-Butylphenyl)methoxy]-N-(4-nitrophenyl)thiophene-2-carboxamide (CAS 344272-85-1)
- 9-[(4-tert-Butylphenyl)methyl]-5-methyl-13-nitro-2-oxa-9-azatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3(8),4,6,12,14-hexaen-10-one (CAS 866156-38-9)
- 1-(4-tert-Butylphenyl)-3-{[(4-fluorophenyl)methyl]sulfanyl}-5H,6H,7H-cyclopenta[c]pyridine-4-carbonitrile (CAS 439096-54-5)
- N-(4-butylphenyl)-2-(4-oxo-7-phenylthieno[3,2-d]pyrimidin-3(4H)-yl)acetamide (CAS 1105235-44-6)
- 2-(2-{[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}ethyl)-2,3-dihydro-1H-isoindole-1,3-dione (CAS 477857-45-7)
- N-(4-butylphenyl)-2-((2-((2-hydroxybenzylidene)amino)phenyl)thio)acetamide (CAS 765285-01-6)
Recommended Standards
- SW033291 (CAS 459147-39-8)
- 2,6-Dimethyl-4-(3-(4-pentylcyclohexyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-yl)phenol (CAS 860611-17-2)
- Calcipotriol (CAS 112828-00-9)
- Biotin-C2-S-S-pyridine (CAS 112247-65-1)
- 2-Chloro-2,5-dimethylhexane (CAS 29342-44-7)
- 1-BRomo-2-methylcyclohex-1-ene (CAS 99747-75-8)
- 2-[5-(2-methylcyclopropyl)furan-2-yl]cyclopropane-1-carboxylic acid (CAS 1218328-99-4)
- (E)-4-(4-Methoxybenzylidene)-3,4-dihydro-2H-pyrrole (CAS 749254-91-9)
- 4-fluoranyl-3-(trifluoromethyl)benzamide 4-fluoro-3-(trifluoromethyl)benzamide 67515-57-5 A835785 (CAS 67515-57-5)
- Eplerenone 395665-48-2 (CAS 395665-48-2)
- 3-(3-(1,1-Dioxidotetrahydrothiophen-3-yl)ureido)propanoic acid (CAS 1018300-47-4)
- 2-Fluoro-2-methylpropane-1-sulfonyl chloride (CAS 1849197-29-0)
- 1-(4-Bromo-2,3-difluorophenyl)-2,2,2-trifluoroethan-1-one (CAS 1823361-42-7)
- Semaglutide impurity 75 (CAS CATO-C4X-222675)
Why CATO?
- ISO 17034 accredited reference material producer (CNAS + ANAB dual accreditation)
- 130,000+ catalog items in stock, COA supplied with every batch
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- Technical support: +86 18665070610 / Nicole.chen@cato-chem.com