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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items 4-(1,3-benzodioxol-5-ylmethyl)-N-phenylpiperazine-1-carboxamide , CAS No.B668384
Synonyms
SMR000092081 | CBMicro_047757 | Cambridge id 6239959 | Oprea1_114662 | Oprea1_657700 | MLS000114753 | MLS002585462 | MFGAZEXFQHHYLA-UHFFFAOYSA-N | BDBM188478 | HMS1617A03 | HMS2266F09 | 4-(1,3-benzodioxol-5-ylmethyl)-N-phenylpiperazine-1-carboxamide | US9
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Why this grade for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships 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
SMR000092081 | CBMicro_047757 | Cambridge id 6239959 | Oprea1_114662 | Oprea1_657700 | MLS000114753 | MLS002585462 | MFGAZEXFQHHYLA-UHFFFAOYSA-N | BDBM188478 | HMS1617A03 | HMS2266F09 | 4-(1, 3-benzodioxol-5-ylmethyl)-N-phenylpiperazine-1-carboxamide | US9
Condiciones de almacenamiento de almacenamiento
Room temperature
Propiedades del producto Nombres e identificadores Sonrisas canónicas C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)NC4=CC=CC=C4 IUPAC Name 4-(1,3-benzodioxol-5-ylmethyl)-N-phenylpiperazine-1-carboxamide InChIKey MFGAZEXFQHHYLA-UHFFFAOYSA-N INCHI 1S/C19H21N3O3/c23-19(20-16-4-2-1-3-5-16)22-10-8-21(9-11-22)13-15-6-7-17-18(12-15)25-14-24-17/h1-7,12H,8-11,13-14H2,(H,20,23) Isómeros SMILES C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)NC4=CC=CC=C4 Peso molecular 339.4 Reaxy-Rn 11712983 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=11712983&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 Benzenoids Clase Benzene and substituted derivatives Subclass N-phenylureas Intermediate Tree Nodes Not available Direct Parent N-phenylureas Alternative Parents Piperazine carboxamides Benzodioxoles N-alkylpiperazines Aralkylamines Ureas Trialkylamines Oxacyclic compounds Azacyclic compounds Acetals Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aromatic heteropolycyclic compounds Substituents N-phenylurea - Benzodioxole - Piperazine-1-carboxamide - N-alkylpiperazine - Aralkylamine - 1,4-diazinane - Piperazine - Carbonic acid derivative - Tertiary amine - Tertiary aliphatic amine - Urea - Acetal - Oxacycle - Organoheterocyclic compound - Azacycle - Amine - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Aromatic heteropolycyclic compound Descripción This compound belongs to the class of organic compounds known as n-phenylureas. These are compounds containing a N-phenylurea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a urea 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.
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 Peso molecular 339.400 g/mol XLogP3 2.200 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 3 Exact Mass 339.158 Da Monoisotopic Mass 339.158 Da Topological Polar Surface Area 54.000 Ų Heavy Atom Count 25 Formal Charge 0 Complexity 447.000 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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