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· · COA & SDS available for every product · Same-day shipping on in-stock items Benzyldodecyldimethylammonium Bromide - ≥97%(T) , CAS No.7281-04-1
Synonyms
BENZODODECINIUM BROMIDE (MART.) | FT-0733931 | BENZODODECINIUM BROMIDE (II) | Benzododecinium bromure | Benzalkonium bromide Dimethyl benzyl lauryl ammonium bromide | Ammonyl BR 1244 | Dodecyl dimethyl benzyl ammonium bromide | Benzenemethanaminium, N-dod
Storage
Room temperature,Argon charged,Cool
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Why this grade ≥97%(T) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature,Argon charged,Cool 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 3 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
BENZODODECINIUM BROMIDE (MART.) | FT-0733931 | BENZODODECINIUM BROMIDE (II) | Benzododecinium bromure | Benzalkonium bromide Dimethyl benzyl lauryl ammonium bromide | Ammonyl BR 1244 | Dodecyl dimethyl benzyl ammonium bromide | Benzenemethanaminium, N-dod
Specifications & Purity
≥97%(T)
Storage
Room temperature, Argon charged, Cool
Names and Identifiers Pubchem Sid 504753139 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504753139 Canonical Smiles CCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.[Br-] IUPAC Name benzyl-dodecyl-dimethylazanium;bromide InChIKey KHSLHYAUZSPBIU-UHFFFAOYSA-M INCHI 1S/C21H38N.BrH/c1-4-5-6-7-8-9-10-11-12-16-19-22(2,3)20-21-17-14-13-15-18-21;/h13-15,17-18H,4-12,16,19-20H2,1-3H3;1H/q+1;/p-1 Isomeric SMILES CCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1.[Br-] RTECS BO7875000 Alternate CAS 91080-29-4 Molecular Weight 384.45 Reaxy-Rn 3579193 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3579193&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 Class Benzene and substituted derivatives Subclass Alkyldimethylbenzylammonium halides Intermediate Tree Nodes Not available Direct Parent Alkyldimethylbenzylammonium halides Alternative Parents Phenylmethylamines Benzylamines Aralkylamines Tetraalkylammonium salts Organopnictogen compounds Organic bromide salts Hydrocarbon derivatives Molecular Framework Aromatic homomonocyclic compounds Substituents Alkyldimethylbenzylammonium halide - Phenylmethylamine - Benzylamine - Aralkylamine - Tetraalkylammonium salt - Quaternary ammonium salt - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organic bromide salt - Organic salt - Organonitrogen compound - Amine - Aromatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as alkyldimethylbenzylammonium halides. These are organic compounds consisting of a quaternary ammonium group substituted with a benzyl group, two methyl groups as well as an alkyl chain. These compounds also contain a halogen ion and have the general structure R1[N+](CH3)(CH3)R2.[X-], where R1 = benzyl group, R2 = alkyl chain, and X = halogen atom. 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 Solubility Soluble in water Sensitivity Moisture sensitive. Melt Point(°C) 54 °C Molecular Weight 384.400 g/mol XLogP3 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 1 Rotatable Bond Count 13 Exact Mass 383.219 Da Monoisotopic Mass 383.219 Da Topological Polar Surface Area 0.000 Ų Heavy Atom Count 23 Formal Charge 0 Complexity 240.000 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 2
Citations of This Product References 1. Chuanhui Teng, Wei Lv, Yuqin Chen, Linfeng Liu, Jiaqing Yin, Shengnan Li, Zhiyi Min, Qi Zhang, Weichong He, Kunfang Ma, Xinrui Li, Xiang Cao, Hongliang Xin. (2023) Enhanced the treatment of ischemic stroke through intranasal temperature-sensitive hydrogels of edaravone and borneol inclusion complex. INTERNATIONAL JOURNAL OF PHARMACEUTICS, [PMID:38154533 ] [10.1016/j.ijpharm.2023.123748 ] 2. Zhiqiang Han, Busheng Zhang, Jieyao Li, Haoqi Guo, Liying Song, Woon-Ming Lau. (2023) Molecular surface engineering via collision-induced-dissociation-assisted grafting of antimicrobial molecules on self-assembled-silanized glass. SURFACE & COATINGS TECHNOLOGY, [PMID: [10.1016/j.surfcoat.2023.129499 ] 3. Shuang Lin, Changsheng Qu, Dongyao Xu. (2025) Tailoring Hydrophobicity and Selectivity in Organo-Modified Steel Slag Adsorbents for Aromatic Hydrocarbon Remediation from Petroleum Wastewater. COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS, [PMID: [10.1016/j.colsurfa.2025.138772 ]
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