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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items Ro 60-0175 fumarate - ≥98%(HPLC) , CAS No.169675-09-6
Synonyms
Ro 60-0175 fumarate | 1H-Indole-1-ethanamine, 6-chloro-5-fluoro-alpha-methyl-, (alphaS)-, (2E)-2-butenedioate (1:1) | 2, 3-amino- | MS-25253 | (?S)-6-Chloro-5-fluoro-?-methyl-1H-indole-1-ethanamine fumarate | C.I. Azoic Coupling Component 5 | 1H-Indole-1-
Storage
Room temperature,Desiccated
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Why this grade ≥98%(HPLC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature,Desiccated 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 60-0175 fumarate | 1H-Indole-1-ethanamine, 6-chloro-5-fluoro-alpha-methyl-, (alphaS)-, (2E)-2-butenedioate (1:1) | 2, 3-amino- | MS-25253 | (?S)-6-Chloro-5-fluoro-?-methyl-1H-indole-1-ethanamine fumarate | C.I. Azoic Coupling Component 5 | 1H-Indole-1-
Especificaciones y pureza
≥98%(HPLC)
Mecanismos bioquímicos y fisiológicos
Potent, selective 5-HT2receptor agonist; shows selectivity for the 5-HT2Csubtype (pKivalues are 9, 7.5, 5.4, 5.2 and 5.6 for human 5-HT2C, 2A, 1A, 6and7receptors respectively). Centrally active following oral or systemic administrationin vivo.
Condiciones de almacenamiento de almacenamiento
Room temperature, Desiccated
Nombres e identificadores Sonrisas canónicas CC(CN1C=CC2=CC(=C(C=C21)Cl)F)N.C(=CC(=O)O)C(=O)O IUPAC Name (E)-but-2-enedioic acid;(2S)-1-(6-chloro-5-fluoroindol-1-yl)propan-2-amine InChIKey CEPHEXXZGQBXGT-XZTIXWOLSA-N INCHI 1S/C11H12ClFN2.C4H4O4/c1-7(14)6-15-3-2-8-4-10(13)9(12)5-11(8)15;5-3(6)1-2-4(7)8/h2-5,7H,6,14H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+/t7-;/m0./s1 Isómeros SMILES C[C@@H](CN1C=CC2=CC(=C(C=C21)Cl)F)N.C(=C/C(=O)O)\C(=O)O PubChem CID 6446435 Peso molecular 342.75
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 Indoles and derivatives Subclass N-alkylindoles Intermediate Tree Nodes Not available Direct Parent N-alkylindoles Alternative Parents Indoles Unsaturated fatty acids Substituted pyrroles Aryl chlorides Aryl fluorides Benzenoids Dicarboxylic acids and derivatives Heteroaromatic compounds Azacyclic compounds Carboxylic acids Hydrocarbon derivatives Carbonyl compounds Monoalkylamines Organic oxides Organochlorides Organofluorides Molecular Framework Not available Substituents N-alkylindole - Indole - Aryl chloride - Aryl fluoride - Aryl halide - Dicarboxylic acid or derivatives - Fatty acyl - Fatty acid - Benzenoid - Unsaturated fatty acid - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organofluoride - Organochloride - Organohalogen compound - Primary aliphatic amine - Organic nitrogen compound - Hydrocarbon derivative - Amine - Carbonyl group - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Primary amine - Aromatic heteropolycyclic compound Descripción This compound belongs to the class of organic compounds known as n-alkylindoles. These are compounds containing an indole moiety that carries an alkyl chain at the 1-position. 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 (humanos) Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Solubilidad Solvent:water, Max Conc. mg/mL: 1.71, Max Conc. mM: 5; Solvent:DMSO, Max Conc. mg/mL: 6.86, Max Conc. mM: 20 Peso molecular 342.750 g/mol XLogP3 Hydrogen Bond Donor Count 3 Hydrogen Bond Acceptor Count 6 Rotatable Bond Count 4 Exact Mass 342.078 Da Monoisotopic Mass 342.078 Da Topological Polar Surface Area 106.000 Ų Heavy Atom Count 23 Formal Charge 0 Complexity 346.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 1 Undefined Atom Stereocenter Count 0 Defined Bond Stereocenter Count 1 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 1 Covalently-Bonded Unit Count 2
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