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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items Ro 67-7476 - ≥99%(HPLC) , CAS No.298690-60-5
Synonyms
Ro 67-7476 | NCGC00370915-01 | (2S)-2-(4-Fluorophenyl)-1-[(4-methylphenyl)sulfonyl]-pyrrolidine | (S)-2-(4-fluoro-phenyl)-1-(toluene-4-sulfonyl)-pyrrolidine | DTXSID80652763 | Ro-67-7476 | HY-100403 | Pyrrolidine, 2-(4-fluorophenyl)-1-[(4-methylphenyl)sul
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Why this grade ≥99%(HPLC) 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
Ro 67-7476 | NCGC00370915-01 | (2S)-2-(4-Fluorophenyl)-1-[(4-methylphenyl)sulfonyl]-pyrrolidine | (S)-2-(4-fluoro-phenyl)-1-(toluene-4-sulfonyl)-pyrrolidine | DTXSID80652763 | Ro-67-7476 | HY-100403 | Pyrrolidine, 2-(4-fluorophenyl)-1-[(4-methylphenyl)sul
Especificaciones y pureza
≥99%(HPLC)
Mecanismos bioquímicos y fisiológicos
Positive allosteric modulator of mGlu1receptors. Potentiates glutamate-induced calcium release (EC50= 60.1 nM at rat mGluR1a). Displays no activity at human mGlu1receptors.
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores Sonrisas canónicas CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C3=CC=C(C=C3)F IUPAC Name (2S)-2-(4-fluorophenyl)-1-(4-methylphenyl)sulfonylpyrrolidine InChIKey DAEHFYNGSSBGSS-KRWDZBQOSA-N INCHI 1S/C17H18FNO2S/c1-13-4-10-16(11-5-13)22(20,21)19-12-2-3-17(19)14-6-8-15(18)9-7-14/h4-11,17H,2-3,12H2,1H3/t17-/m0/s1 Isómeros SMILES CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C3=CC=C(C=C3)F PubChem CID 32681978 Peso molecular 319.39
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 Toluenes Intermediate Tree Nodes Tosyl compounds - P-toluenesulfonamides Direct Parent N,N-disubstituted p-toluenesulfonamides Alternative Parents Phenylpyrrolidines Benzenesulfonamides Benzenesulfonyl compounds Fluorobenzenes Organosulfonamides Aryl fluorides Sulfonyls Pyrroles Azacyclic compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents N,n-disubstituted p-toluenesulfonamide - 2-phenylpyrrolidine - Benzenesulfonamide - Benzenesulfonyl group - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Organosulfonic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrolidine - Pyrrole - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organosulfur compound - Organic nitrogen compound - Aromatic heteromonocyclic compound Descripción This compound belongs to the class of organic compounds known as n,n-disubstituted p-toluenesulfonamides. These are p-toluenesulfonamide derivatives in which the sulfonamide moiety is N,N-disubstituted. 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 Objetivos asociados (no humanos) Mecanismos de acción Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Solubilidad Solvent:DMSO, Max Conc. mg/mL: 31.94, Max Conc. mM: 100 Peso molecular 319.400 g/mol XLogP3 3.600 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 3 Exact Mass 319.104 Da Monoisotopic Mass 319.104 Da Topological Polar Surface Area 45.800 Ų Heavy Atom Count 22 Formal Charge 0 Complexity 460.000 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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