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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items 1-tert-butyl 3-methyl (3S)-pyrrolidine-1,3-dicarboxylate - ≥97% , CAS No.313706-15-9
Synonyms
AKOS022177561 | (S)-1-Boc-pyrrolidine-3-carboxylic acid methyl ester | 1-(tert-butyl) 3-methyl (S)-pyrrolidine-1,3-dicarboxylate | (S)-1-tert-butyl 3-methyl pyrrolidine-1,3-dicarboxylate | 1-tert-butyl 3-methyl (3S)-pyrrolidine-1,3-dicarboxylate | A26488
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Why this grade ≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping 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.
Specifications Sinónimos
AKOS022177561 | (S)-1-Boc-pyrrolidine-3-carboxylic acid methyl ester | 1-(tert-butyl) 3-methyl (S)-pyrrolidine-1, 3-dicarboxylate | (S)-1-tert-butyl 3-methyl pyrrolidine-1, 3-dicarboxylate | 1-tert-butyl 3-methyl (3S)-pyrrolidine-1, 3-dicarboxylate | A26488
Especificaciones y pureza
≥97%
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores Sonrisas canónicas CC(C)(C)OC(=O)N1CCC(C1)C(=O)OC IUPAC Name 1-O-tert-butyl 3-O-methyl (3S)-pyrrolidine-1,3-dicarboxylate InChIKey LIWFYAVKYUQMRE-QMMMGPOBSA-N INCHI 1S/C11H19NO4/c1-11(2,3)16-10(14)12-6-5-8(7-12)9(13)15-4/h8H,5-7H2,1-4H3/t8-/m0/s1 Isómeros SMILES CC(C)(C)OC(=O)N1CC[C@@H](C1)C(=O)OC Peso molecular 229.276 Reaxy-Rn 3612162 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3612162&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 Clase Pyrrolidines Subclass Pyrrolidine carboxylic acids and derivatives Intermediate Tree Nodes Not available Direct Parent Pyrrolidine carboxylic acids Alternative Parents Methyl esters Carbamate esters Organic carbonic acids and derivatives Monocarboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aliphatic heteromonocyclic compounds Substituents Pyrrolidine carboxylic acid - Carbamic acid ester - Methyl ester - Carboxylic acid ester - Carbonic acid derivative - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Aliphatic heteromonocyclic compound Descripción 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.
Estructura 3D Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Peso molecular 229.270 g/mol XLogP3 1.100 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 4 Exact Mass 229.131 Da Monoisotopic Mass 229.131 Da Topological Polar Surface Area 55.800 Ų Heavy Atom Count 16 Formal Charge 0 Complexity 282.000 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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