1-(4-Chlorophenyl)-3-{[(3-fluorophenyl)methyl]sulfanyl}-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile CAS 439096-92-1
| CAS No. | 439096-92-1 |
| Molecular Formula | C23H18ClFN2S |
| Molecular Weight | 408.92 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Owing to a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, fluorine/chlorine substitution, 1-(4-Chlorophenyl)-3-{[(3-fluorophenyl)methyl]sulfanyl}-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile is typically pale yellow to yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 408.92 g/mol — guide the selection of appropriate sample preparation and analytical techniques. 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).
1-(4-Chlorophenyl)-3-{[(3-fluorophenyl)methyl]sulfanyl}-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile (CAS 439096-92-1), molecular formula C23H18ClFN2S and molecular weight 408.92 g/mol, is a CATO reference standard with documented purity and traceability.
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 1-(4-Chlorophenyl)-3-{[(3-fluorophenyl)methyl]sulfanyl}-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.
Physical & Chemical Properties
| Molecular Formula | C23H18ClFN2S |
| Molecular Weight | 408.92 g/mol |
| Purity | 97%+ |
| Storage | Store at room temperature, protect from light |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | May oxidize slowly on prolonged air exposure; 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 |
| Halogen Content | F/Cl-containing |
| Nitrogen Atoms | 2 |
| Sulfur Atoms | 1 |
Related Chlorophenyl Standards
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Recommended Standards
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- 1-Tosyl-1H-indole-5-carbonitrile (CAS 32685-23-7)
- 1-(Benzo[d][1,3]dioxol-5-yl)-5-((pyrimidin-2-ylthio)methyl)-1H-1,2,3-triazole-4-carboxylic acid (CAS 1416346-84-3)
- 5-(2-Chloroacetamido)-2,4,6-triiodo-isophthalic Acid (CAS 4873-45-4)
- 2-Butenedioic acid (2Z)-, 1,4-dibutyl ester, polymer with 1,4-dioctyl (2Z)-2-butenedioate and ethenyl acetate (CAS 58923-93-6)
- 5-Cyano-2,4-difluorobenzoic acid (CAS 1378788-81-8)
- Emtricitabine Diastereomer (RS ISOMER ) (CAS 143491-54-7)
- Semaglutide Impurity 165 (CAS CATO-C4X-2226165)
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