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· · COA & SDS available for every product · Same-day shipping on in-stock items (S)-(-)-1-Boc-2-pyrrolidinecarbonitrile - ≥97% , CAS No.228244-04-0
Synonyms
(S)-1-Boc-2-pyrrolidinecarbonitrile | Ald3-H_000013 | (R)-N-BOC-2-pyrrolidinonitrile | tert-butyl(2S)-2-cyano-1-pyrrolidinecarboxylate | A4857 | DTXSID10426237 | tert-butyl (2S)-2-cyanopyrrolidine-1-carboxylate | PD139958 | (S)-tert-butyl 2-cyanopyrrolidi
Storage
Protected from light,Argon charged,Room temperature
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Why this grade ≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Protected from light,Argon charged,Room temperature Ships Normal Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Overview Used in synthesis of prolyl oligopeptidase inhibitors.
Specifications Synonyms
(S)-1-Boc-2-pyrrolidinecarbonitrile | Ald3-H_000013 | (R)-N-BOC-2-pyrrolidinonitrile | tert-butyl(2S)-2-cyano-1-pyrrolidinecarboxylate | A4857 | DTXSID10426237 | tert-butyl (2S)-2-cyanopyrrolidine-1-carboxylate | PD139958 | (S)-tert-butyl 2-cyanopyrrolidi
Specifications & Purity
≥97%
Storage
Protected from light, Argon charged, Room temperature
Names and Identifiers Pubchem Sid 504764409 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504764409 Canonical Smiles CC(C)(C)OC(=O)N1CCCC1C#N IUPAC Name tert-butyl (2S)-2-cyanopyrrolidine-1-carboxylate InChIKey MDMSZBHMBCNYNO-QMMMGPOBSA-N INCHI 1S/C10H16N2O2/c1-10(2,3)14-9(13)12-6-4-5-8(12)7-11/h8H,4-6H2,1-3H3/t8-/m0/s1 Isomeric SMILES CC(C)(C)OC(=O)N1CCC[C@H]1C#N WGK Germany 3 Molecular Weight 196.25 Reaxy-Rn 5811496 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5811496&ln=
Documentation 📋 Safety Data Sheet (SDS) Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS → ✅ Certificate of Analysis (COA) Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA → 📊 Datasheet Quick-reference summary of product specifications and applications.
View datasheet → 🔬 Specification Sheet Full quality attributes and acceptance criteria for this grade.
View spec sheet →
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Organoheterocyclic compounds Class Pyrrolidines Subclass Pyrrolidine carboxylic acids and derivatives Intermediate Tree Nodes Not available Direct Parent Pyrrolidine carboxylic acids Alternative Parents Carbamate esters Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aliphatic heteromonocyclic compounds Substituents Pyrrolidine carboxylic acid - Carbamic acid ester - Azacycle - Nitrile - Carbonitrile - Organic nitrogen compound - Organic oxygen compound - Cyanide - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aliphatic heteromonocyclic compound Description This compound belongs to the class of organic compounds known as pyrrolidine carboxylic acids. These are compounds containing a pyrrolidine ring which bears a carboxylic acid. Pyrrolidine is a five-membered saturated aliphatic heterocycle with one nitrogen atom and four carbon atoms. External Descriptors Not available Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D Structure Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Solubility Slightly soluble in water. Sensitivity Moisture sensitive；Light sensitive Specific Rotation[α] -105.5° Flash Point(°F) 230 °F Flash Point(°C) 110 °C Melt Point(°C) 33-36°C Molecular Weight 196.250 g/mol XLogP3 1.400 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 2 Exact Mass 196.121 Da Monoisotopic Mass 196.121 Da Topological Polar Surface Area 53.300 Ų Heavy Atom Count 14 Formal Charge 0 Complexity 272.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 1 Undefined Atom Stereocenter Count 0 Defined Bond Stereocenter Count 0 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 0 Covalently-Bonded Unit Count 1
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