Methyl 3-((3-cyanobenzyl)thio)butanoate CAS 1424395-85-6
| CAS No. | 1424395-85-6 |
| Molecular Formula | C13H15NO2S |
| Molecular Weight | 249.33 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Methyl 3-((3-cyanobenzyl)thio)butanoate (CAS 1424395-85-6), molecular formula C13H15NO2S and molecular weight 249.33 g/mol, is a CATO reference standard with documented purity and traceability.
Owing to a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage, Methyl 3-((3-cyanobenzyl)thio)butanoate is typically off-white to pale yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 249.33 g/mol — guide the selection of appropriate sample preparation and analytical techniques. The high carbon-to-hydrogen ratio imparts good lipophilicity, allowing liquid-liquid extraction with non-polar solvents such as n-hexane or ethyl acetate.
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 Methyl 3-((3-cyanobenzyl)thio)butanoate 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 | C13H15NO2S |
| Molecular Weight | 249.33 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light |
| Solubility (reference) | Soluble in chloroform, dichloromethane, ethyl acetate, DMSO |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 7.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1991 |
| Nitrogen Atoms | 1 |
| Sulfur Atoms | 1 |
Related Methyl Standards
- Methyl 3-((4-cyanobenzyl)thio)-2-methylpropanoate (CAS 1427573-27-0)
- (4-((4-Cyanobenzyl)oxy)phenyl)boronic acid (CAS 1256355-70-0)
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- 2-(Butyl(2-cyanobenzyl)amino)acetamide (CAS 1303745-88-1)
Recommended Standards
- 2-((1,1-Dioxidotetrahydrothiophen-3-yl)amino)hexanoic acid (CAS 1396962-56-3)
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- 3-(4-Isobutoxy-1,2,5-thiadiazol-3-yl)aniline (CAS 1365938-99-3)
- 2-Bromo-3,4-dimethylbenzophenone (CAS 951892-44-7)
- Ethyl (4-amino-1,1-dioxidotetrahydrothiophen-3-yl)carbamate (CAS 300670-11-5)
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- tert-Butyl (1S,4S)-1-(((methylsulfonyl)oxy)methyl)-2-oxa-5-azabicyclo[2.2.1]heptane-5-carboxylate (CAS 2810050-60-1)
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- 4-((Benzyloxy)methyl)cyclohexanone (CAS 132452-43-8)
- D-Ile17-Tirzepatide (CAS CATO-CPTD788917)
Why CATO?
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