Octadecyldimethyltrimethoxysilylpropylammoniumchlorideinme solution (DTSACl) - 40 wt. % in methanol，contains (3-chloropropyl)trimethoxysilane , CAS No.27668-52-6

CAS: 27668-52-6 Cat. No.: O197305 Molecular Weight: 496.28 EC Number: 248-595-8

GRADE & PURITY 40 wt. % in methanol，contains (3-chloropropyl)trimethoxysilane

Synonyms

3-(trimethoxysilyl)-propyldimethyloctadecyl ammonium chloride | Q27280845 | Polon MF 50 | dimethyl-n-octadecyl [3(trimethoxysilyl)propyl]ammonium chloride | dimethyl-n-octadecyl [3(trimethoxysilyl)propyl] ammonium chloride | DK-Q 8-8905 | Octadecyldimethy

Storage

Room temperature

Shipped In

Normal

Overview

Dimethyloctadecy[3-(trimethoxysilyl)propyl]ammonium chloride solution (DTSACl) is a silane coupling reagent.
DTSACl may be used for modification of silica. It was used to functionalize Fe3O4/silica core-shell nanoparticles. DTSACl may be used as a precursor to form silica, 3 and MeMFI zeolite. It acts as a mesopore-generating agent.

Specifications

Synonyms

3-(trimethoxysilyl)-propyldimethyloctadecyl ammonium chloride | Q27280845 | Polon MF 50 | dimethyl-n-octadecyl [3(trimethoxysilyl)propyl]ammonium chloride | dimethyl-n-octadecyl [3(trimethoxysilyl)propyl] ammonium chloride | DK-Q 8-8905 | Octadecyldimethy

Specifications & Purity

40 wt. % in methanol，contains (3-chloropropyl)trimethoxysilane

Storage

Room temperature

Shipped In

Normal

Names and Identifiers

• Canonical Smiles: CCCCCCCCCCCCCCCCCC[N+](C)(C)CCC[Si](OC)(OC)OC.[Cl-]
• IUPAC Name: dimethyl-octadecyl-(3-trimethoxysilylpropyl)azanium;chloride
• InChIKey: WSFMFXQNYPNYGG-UHFFFAOYSA-M
• INCHI: 1S/C26H58NO3Si.ClH/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-27(2,3)25-23-26-31(28-4,29-5)30-6;/h7-26H2,1-6H3;1H/q+1;/p-1
• Isomeric SMILES: CCCCCCCCCCCCCCCCCC[N+](C)(C)CCC[Si](OC)(OC)OC.[Cl-]
• Molecular Weight: 496.28
• Reaxy-Rn: 4897339
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4897339&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organometallic compounds
    • Class Organometalloid compounds
      • Subclass Organosilicon compounds
        • Level5 Alkoxysilanes
          • Level6 Trialkoxysilanes

• Kingdom: Organic compounds
• Superclass: Organometallic compounds
• Class: Organometalloid compounds
• Subclass: Organosilicon compounds
• Intermediate Tree Nodes: Alkoxysilanes
• Direct Parent: Trialkoxysilanes
• Alternative Parents: Tetraalkylammonium salts Silyl ethers Organoheterosilanes Organic metalloid salts Organopnictogen compounds Organooxygen compounds Organic chloride salts Hydrocarbon derivatives Amines
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Trialkoxysilane - Quaternary ammonium salt - Tetraalkylammonium salt - Silyl ether - Organic metalloid salt - Organoheterosilane - Organic chloride salt - Organic salt - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Amine - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as trialkoxysilanes. These are organosilicon compounds with the general formula RO[Si](R')(OR'')OR''' (R-R''' = aliphatic organyl 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.

DOI: 10.1186/s13321-016-0174-y

Mechanisms of Action

Chemical and Physical Properties

• Sensitivity: Moisture sensitive
• Refractive Index: 1.3889
• Flash Point(°F): 51.8 °F
• Flash Point(°C): 11℃
• Molecular Weight: 496.300 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 24
• Exact Mass: 495.387 Da
• Monoisotopic Mass: 495.387 Da
• Topological Polar Surface Area: 27.700 Ų
• Heavy Atom Count: 32
• Formal Charge: 0
• Complexity: 367.000
• 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

XLogP3

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