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· · COA & SDS available for every product · Same-day shipping on in-stock items 1-Benzenesulfonyl-4-o-tolyl-piperazine , CAS No.B668470
Synonyms
1-Benzenesulfonyl-4-o-tolyl-piperazine | MLS000035471 | 1-(benzenesulfonyl)-4-(2-methylphenyl)piperazine | SMR000123050 | Oprea1_465054 | Oprea1_490710 | cid_740952 | 1-besyl-4-(o-tolyl)piperazine | BDBM46862 | HMS1795N08 | HMS2418G18 | AKOS000545720 | NC
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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 Synonyms
1-Benzenesulfonyl-4-o-tolyl-piperazine | MLS000035471 | 1-(benzenesulfonyl)-4-(2-methylphenyl)piperazine | SMR000123050 | Oprea1_465054 | Oprea1_490710 | cid_740952 | 1-besyl-4-(o-tolyl)piperazine | BDBM46862 | HMS1795N08 | HMS2418G18 | AKOS000545720 | NC
Product Properties Names and Identifiers Canonical Smiles CC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3 IUPAC Name 1-(benzenesulfonyl)-4-(2-methylphenyl)piperazine InChIKey LHZKIJOVBGFZJL-UHFFFAOYSA-N INCHI 1S/C17H20N2O2S/c1-15-7-5-6-10-17(15)18-11-13-19(14-12-18)22(20,21)16-8-3-2-4-9-16/h2-10H,11-14H2,1H3 Isomeric SMILES CC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3 PubChem CID 740952 Molecular Weight 316.4
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 Class Diazinanes Subclass Piperazines Intermediate Tree Nodes Not available Direct Parent Phenylpiperazines Alternative Parents N-arylpiperazines Benzenesulfonamides Benzenesulfonyl compounds Dialkylarylamines Aniline and substituted anilines Aminotoluenes Organosulfonamides Sulfonyls Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents Phenylpiperazine - N-arylpiperazine - Benzenesulfonamide - Benzenesulfonyl group - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Aminotoluene - Toluene - Monocyclic benzene moiety - Benzenoid - Organosulfonic acid amide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Tertiary amine - Azacycle - Amine - Organic oxide - Organic oxygen compound - Organosulfur compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Aromatic heteromonocyclic compound Description This compound belongs to the class of organic compounds known as phenylpiperazines. These are compounds containing a phenylpiperazine skeleton, which consists of a piperazine 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.
3D Structure Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Molecular Weight 316.400 g/mol XLogP3 3.000 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 3 Exact Mass 316.125 Da Monoisotopic Mass 316.125 Da Topological Polar Surface Area 49.000 Ų Heavy Atom Count 22 Formal Charge 0 Complexity 446.000 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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