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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items [3-hydroxy-3-[(2S)-2-piperidyl]azetidin-1-yl]-(2,3,4-trifluorophenyl)methanone;hydrochloride - ≥97% , CAS No.2065147-70-6
Synonyms
2065147-70-6 | [3-hydroxy-3-[(2S)-2-piperidyl]azetidin-1-yl]-(2,3,4-trifluorophenyl)methanone | hydrochloride | (S)-(3-Hydroxy-3-(piperidin-2-yl)azetidin-1-yl)(2,3,4-trifluorophenyl)methanone hydrochloride | [3-hydroxy-3-[(2S)-piperidin-2-yl]azetidin-1-yl
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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
2065147-70-6 | [3-hydroxy-3-[(2S)-2-piperidyl]azetidin-1-yl]-(2, 3, 4-trifluorophenyl)methanone | hydrochloride | (S)-(3-Hydroxy-3-(piperidin-2-yl)azetidin-1-yl)(2, 3, 4-trifluorophenyl)methanone hydrochloride | [3-hydroxy-3-[(2S)-piperidin-2-yl]azetidin-1-yl
Especificaciones y pureza
≥97%
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores Sonrisas canónicas C1CCNC(C1)C2(CN(C2)C(=O)C3=C(C(=C(C=C3)F)F)F)O.Cl IUPAC Name [3-hydroxy-3-[(2S)-piperidin-2-yl]azetidin-1-yl]-(2,3,4-trifluorophenyl)methanone;hydrochloride InChIKey IIOWVEOHMXUBOY-MERQFXBCSA-N INCHI 1S/C15H17F3N2O2.ClH/c16-10-5-4-9(12(17)13(10)18)14(21)20-7-15(22,8-20)11-3-1-2-6-19-11;/h4-5,11,19,22H,1-3,6-8H2;1H/t11-;/m0./s1 Isómeros SMILES C1CCN[C@@H](C1)C2(CN(C2)C(=O)C3=C(C(=C(C=C3)F)F)F)O.Cl PubChem CID 92131086 Peso molecular 350.76
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 Benzenoids Clase Benzene and substituted derivatives Subclass Benzoic acids and derivatives Intermediate Tree Nodes Halobenzoic acids and derivatives Direct Parent 4-halobenzoic acids and derivatives Alternative Parents 2-halobenzoic acids and derivatives 3-halobenzoic acids and derivatives Benzamides Benzoyl derivatives Fluorobenzenes Piperidines Aryl fluorides Vinylogous halides Tertiary carboxylic acid amides Tertiary alcohols 1,2-aminoalcohols Amino acids and derivatives Azetidines Dialkylamines Azacyclic compounds Hydrocarbon derivatives Hydrochlorides Organofluorides Organic oxides Molecular Framework Aromatic heteromonocyclic compounds Substituents 2-halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Benzamide - Benzoyl - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Piperidine - Vinylogous halide - Tertiary carboxylic acid amide - Tertiary alcohol - Amino acid or derivatives - Azetidine - 1,2-aminoalcohol - Carboxamide group - Secondary amine - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Secondary aliphatic amine - Organofluoride - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Amine - Alcohol - Hydrochloride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound Descripción This compound belongs to the class of organic compounds known as 4-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 4-position of the benzene ring. 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 350.760 g/mol XLogP3 Hydrogen Bond Donor Count 3 Hydrogen Bond Acceptor Count 6 Rotatable Bond Count 2 Exact Mass 350.101 Da Monoisotopic Mass 350.101 Da Topological Polar Surface Area 52.600 Ų Heavy Atom Count 23 Formal Charge 0 Complexity 431.000 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 2
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