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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items 4-(Hydroxymethyl)-1-isopropylpyrrolidin-2-one - Reagent grade , CAS No.59857-88-4
GRADE & PURITY Reagent Grade ? General reagent-grade purity suitable for most laboratory work. Use as a dependable default when no specific higher grade is required. Synonyms
HJRSONVKDMDDFC-UHFFFAOYSA-N | AKOS005207143 | AT19131 | F2147-0248 | 4-(hydroxymethyl)-1-isopropylpyrrolidin-2-one | SCHEMBL11534030 | 4-(hydroxymethyl)-1-(propan-2-yl)pyrrolidin-2-one | 4-(Hydroxymethyl)-1-isopropyl-2-pyrrolidinone | CHEMBRDG-BB 4015569
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Why this grade Reagent grade Reagent Grade for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships 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
HJRSONVKDMDDFC-UHFFFAOYSA-N | AKOS005207143 | AT19131 | F2147-0248 | 4-(hydroxymethyl)-1-isopropylpyrrolidin-2-one | SCHEMBL11534030 | 4-(hydroxymethyl)-1-(propan-2-yl)pyrrolidin-2-one | 4-(Hydroxymethyl)-1-isopropyl-2-pyrrolidinone | CHEMBRDG-BB 4015569
Especificaciones y pureza
Reagent grade
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores Sonrisas canónicas CC(C)N1CC(CC1=O)CO IUPAC Name 4-(hydroxymethyl)-1-propan-2-ylpyrrolidin-2-one InChIKey HJRSONVKDMDDFC-UHFFFAOYSA-N INCHI 1S/C8H15NO2/c1-6(2)9-4-7(5-10)3-8(9)11/h6-7,10H,3-5H2,1-2H3 Isómeros SMILES CC(C)N1CC(CC1=O)CO Peso molecular 157.21 Reaxy-Rn 1448436 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1448436&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 N-alkylpyrrolidines Intermediate Tree Nodes Not available Direct Parent N-alkylpyrrolidines Alternative Parents Pyrrolidine-2-ones Tertiary carboxylic acid amides Lactams Azacyclic compounds Primary alcohols Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aliphatic heteromonocyclic compounds Substituents Pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - Tertiary carboxylic acid amide - Carboxamide group - Lactam - Carboxylic acid derivative - Azacycle - Organic oxide - Organopnictogen compound - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Alcohol - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Aliphatic heteromonocyclic compound Descripción This compound belongs to the class of organic compounds known as n-alkylpyrrolidines. These are compounds containing a pyrrolidine moiety that is substituted at the N1-position with an alkyl group. 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 157.210 g/mol XLogP3 -0.200 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 2 Exact Mass 157.11 Da Monoisotopic Mass 157.11 Da Topological Polar Surface Area 40.500 Ų Heavy Atom Count 11 Formal Charge 0 Complexity 156.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 1 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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