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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items Dothiepin hydrochloride - ≥95% , CAS No.897-15-4
Synonyms
CHEBI:36805 | Dothiepin hydrochloride | 11-[3-(Dimethylamino)propylidene]-6,e]thiepine hydrochloride | 1-Propanamine,e]thiepin-11(6H)-ylidene-N,N-dimethyl-, hydrochloride | AKOS000321190 | DOSULEPIN HYDROCHLORIDE [JAN] | Dothiepin Hydrochloride; Dosulepin
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Why this grade ≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Store at 2-8°C Ships Wet ice 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.
Descripción general Dothiepin hydrochloride is a tricyclic antidepressant.
Specifications Sinónimos
CHEBI:36805 | Dothiepin hydrochloride | 11-[3-(Dimethylamino)propylidene]-6, e]thiepine hydrochloride | 1-Propanamine, e]thiepin-11(6H)-ylidene-N, N-dimethyl-, hydrochloride | AKOS000321190 | DOSULEPIN HYDROCHLORIDE [JAN] | Dothiepin Hydrochloride; Dosulepin
Especificaciones y pureza
≥95%
Condiciones de almacenamiento de almacenamiento
Store at 2-8°C
Enviado en
Wet ice
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Nombres e identificadores Sonrisas canónicas CN(C)CCC=C1C2=CC=CC=C2CSC3=CC=CC=C31.Cl IUPAC Name (3E)-3-(6H-benzo[c][1]benzothiepin-11-ylidene)-N,N-dimethylpropan-1-amine;hydrochloride InChIKey XUPZAARQDNSRJB-SJDTYFKWSA-N INCHI 1S/C19H21NS.ClH/c1-20(2)13-7-11-17-16-9-4-3-8-15(16)14-21-19-12-6-5-10-18(17)19;/h3-6,8-12H,7,13-14H2,1-2H3;1H/b17-11+; Isómeros SMILES CN(C)CC/C=C/1\C2=CC=CC=C2CSC3=CC=CC=C31.Cl WGK Alemania 3 RTECS HQ2975000 Peso molecular 331.90 Reaxy-Rn 4339832 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4339832&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 Benzothiepins Subclass Dibenzothiepins Intermediate Tree Nodes Not available Direct Parent Dibenzothiepins Alternative Parents Alkylarylthioethers Benzenoids Trialkylamines Organopnictogen compounds Organic chloride salts Hydrocarbon derivatives Molecular Framework Aromatic heteropolycyclic compounds Substituents Dibenzothiepin - Aryl thioether - Alkylarylthioether - Benzenoid - Tertiary aliphatic amine - Tertiary amine - Thioether - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organic chloride salt - Organic salt - Organonitrogen compound - Amine - Aromatic heteropolycyclic compound Descripción This compound belongs to the class of organic compounds known as dibenzothiepins. These are compounds containing a dibenzothiepin moiety, which consists of two benzene connected by a thiepine ring. External Descriptors dothiepin hydrochloride 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) Objetivos asociados (no humanos) Mecanismos de acción Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Solubilidad Soluble in DMSO (≥26 mg/mL), water (1:2), alcohol (1:8), and chloroform (1:2). Índice de refracción n20D~1.66 (Predicted) Peso molecular 331.900 g/mol XLogP3 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 3 Exact Mass 331.116 Da Monoisotopic Mass 331.116 Da Topological Polar Surface Area 28.500 Ų Heavy Atom Count 22 Formal Charge 0 Complexity 363.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 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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