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· · COA & SDS disponible pour chaque produit · Expédition le jour même sur les articles en stock Anle138b - ≥98%(HPLC) , CAS No.882697-00-9
Synonyms
Tox21_200409 | AC-25903 | E7WRA77JET | A858288 | Anle138b | ANLE-138b | D80685 | AKOS037649277 | Emrusolmin | BCP32558 | Emrusolmin [INN] | SCHEMBL21440048 | s6782 | 3-(1,3-dioxaindan-5-yl)-5-(3-bromophenyl)-1H-pyrazole | SCHEMBL1660250 | UNII-E7WRA77JET
Shipped In
Glacière + blocs de glace
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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 Conserver à -20°C Ships Glacière + blocs de glace 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 Synonymes
Tox21_200409 | AC-25903 | E7WRA77JET | A858288 | Anle138b | ANLE-138b | D80685 | AKOS037649277 | Emrusolmin | BCP32558 | Emrusolmin [INN] | SCHEMBL21440048 | s6782 | 3-(1,3-dioxaindan-5-yl)-5-(3-bromophenyl)-1H-pyrazole | SCHEMBL1660250 | UNII-E7WRA77JET
Spécifications et pureté
≥98%(HPLC)
Mécanismes biochimiques et physiologiques
Inhibiteur d'agrégation oligomérique. Inhibe la formation d'agrégats de protéines prions pathologiques (PrPSc) et d'α-synucléine in vitro. Empêche l'accumulation de PrPSc dans le cerveau et la rate et prolonge la survie des souris infectées par les prions
Conditions de stockage de stockage
Conserver à -20°C
Expédié en
Glacière + blocs de glace
Noms et identifiants Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/504770397
Sourires canoniques
C1OC2=C(O1)C=C(C=C2)C3=CC(=NN3)C4=CC(=CC=C4)Br
IUPAC Name
5-(1,3-benzodioxol-5-yl)-3-(3-bromophenyl)-1H-pyrazole
InChIKey
RCQIIBJSUWYYFU-UHFFFAOYSA-N
INCHI
1S/C16H11BrN2O2/c17-12-3-1-2-10(6-12)13-8-14(19-18-13)11-4-5-15-16(7-11)21-9-20-15/h1-8H,9H2,(H,18,19)
Isomères SMILES
C1OC2=C(O1)C=C(C=C2)C3=CC(=NN3)C4=CC(=CC=C4)Br
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=10174781&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 Classe Azoles Subclass Pyrazoles Intermediate Tree Nodes Not available Direct Parent Phenylpyrazoles Alternative Parents Benzodioxoles Bromobenzenes Aryl bromides Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Acetals Organopnictogen compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives Molecular Framework Aromatic heteropolycyclic compounds Substituents Phenylpyrazole - Benzodioxole - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Acetal - Oxacycle - Azacycle - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as phenylpyrazoles. These are compounds containing a phenylpyrazole skeleton, which consists of a pyrazole bound to a phenyl group. 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.
Structure 3D Cibles associées (humaines) Mécanismes d'action Certificats (CoA, COO, BSE/TSE et tableau d'analyse) Propriétés chimiques et physiques Solubilité Solvent:DMSO, Max Conc. mg/mL: 17.16, Max Conc. mM: 50 Poids moléculaire 343.170 g/mol XLogP3 4.000 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 2 Exact Mass 342 Da Monoisotopic Mass 342 Da Topological Polar Surface Area 47.100 Ų Heavy Atom Count 21 Formal Charge 0 Complexity 370.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 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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