4-Cyano-4-(phenylcarbonothioylthio)pentanoic acid, 98%
Order 4-Cyano-4-(phenylcarbonothioylthio)pentanoic acid, 98% (CAS 201611-92-9) online at Zemixal. Request a quote with price, lead time and documents.
About 4-Cyano-4-(phenylcarbonothioylthio)pentanoic acid, 98%
4-Cyano-4-(phenylcarbonothioylthio)pentanoic acid, 98% is part of the Zemixal sulfur Compounds (Thiols, Sulfides, Sulfonates) range. Key data (98%): CAS 201611-92-9, formula C13H13NO2S2 and molar mass 279.4 g/mol. It is described as faint red to very dark red and pink powder or crystals.
Use cases we see most often
- Organic synthesis
- API synthesis
Safe handling
Store at 2–8 °C. Literature values: melting point 94-101 °C. It carries the GHS signal word Warning (H317), so wear gloves and eye protection and work with good ventilation.
Available as 1 g and 5 g. Larger or split packs can be arranged. You receive a batch certificate of analysis and a 16-section SDS with each order. Send an enquiry through the quote panel and you get a formal offer with Incoterms and delivery time.
Typical uses
- Organic synthesis
- API synthesis
Applications
Specifications and identifiers
| Product name | 4-Cyano-4-(phenylcarbonothioylthio)pentanoic acid, 98% |
|---|---|
| Catalogue number | ZX-009852 |
| CAS number | 201611-92-9 |
| IUPAC name | 4-(benzenecarbonothioylsulfanyl)-4-cyanopentanoic acid |
| Molecular formula | C13H13NO2S2 |
| Molar mass | 279.4 g/mol |
| Exact mass | 279.0388 |
| Purity / assay | 98% |
| Physical form | Crystalline |
| Appearance | Faint red to very dark red and pink powder or crystals |
| Melting point | 94-101 °C |
| XLogP3 | 2.8 |
| H-bond donors / acceptors | 1 / 5 |
| Topological polar surface area | 118 Ų |
| Storage | 2–8 °C |
| HS code | 29420090 |
| InChIKey | YNKQCPNHMVAWHN-UHFFFAOYSA-N |
| SMILES | CC(CCC(=O)O)(C#N)SC(=S)C1=CC=CC=C1 |
| PubChem CID | 9921763 |
| Synonyms | 4-Cyano-4-(thiobenzoylthio)pentanoic acid, 4-Cyano-4-((phenylcarbonothioyl)thio)pentanoic acid, 4-Cyano-4-[(phenylcarbonothioyl)thio]pentanoic Acid, Pentanoic acid, 4-cyano-4-[(phenylthioxomethyl)thio]-, 4-Cyano-4-((phenylcarbonothioyl)thio)pentanoicacid, 4-Cyano-4-[, 4-(benzenecarbonothioylsulfanyl)-4-cyano-pentanoic Acid, 4-cyano-4-thiobenzoylsulfanyl-pentanoic acid, 4-cyano-4-((thiobenzoyl)sulfanyl)-pentanoic acid, 4-[(Benzenecarbothioyl)sulfanyl]-4-cyanopentanoic acid, 4-Cyano-4-(phenylcarbonothioylthio)pentanoic acid, >97% |
Lot values are stated on the batch certificate of analysis. Ask for a typical COA with your quotation.
Safety and GHS hazards
Signal word Warning
- H317May cause an allergic skin reaction
Precautionary statements P261, P272, P280, P302 + P352, P321, P333 + P317, P362 + P364, P501
Classification summarised from public GHS notifications. It can vary with grade and concentration, so always follow the SDS supplied with your lot.
Pack sizes
| 1 g | Quoted on request | |
| 5 g | Quoted on request |
Need a different size? Bulk drums and custom packing are quoted on request through the quote form on this page.
Questions about 4-Cyano-4-(phenylcarbonothioylthio)pentanoic acid, 98%
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