Trimethyl[3-(triethoxysilyl)propyl]ammonium Chloride - ≥98%(T) , CAS No.84901-27-9

CAS: 84901-27-9 Cat. No.: T162291 Molecular Weight: 299.91 EC Number: 284-463-6 PubChem CID: 23002981

GRADE & PURITY ≥98%(T)

Synonyms

EINECS 284-463-6 | 2-O-ETHYL-L-ASCORBICACID | 3-TRIETHOXYSILYLPROPYLTRIMETHYLAMMONIUM CHLORIDE | T2246 | FT-0766821 | trimethyl(3-triethoxysilylpropyl)azanium;chloride | N,N,N-Trimethyl-3-(triethoxysilyl)propan-1-aminium chloride | AKOS015833169 | DTXSID2

Storage

Room temperature,Argon charged,Desiccated,Cool

Shipped In

Normal

Specifications

Synonyms

EINECS 284-463-6 | 2-O-ETHYL-L-ASCORBICACID | 3-TRIETHOXYSILYLPROPYLTRIMETHYLAMMONIUM CHLORIDE | T2246 | FT-0766821 | trimethyl(3-triethoxysilylpropyl)azanium;chloride | N, N, N-Trimethyl-3-(triethoxysilyl)propan-1-aminium chloride | AKOS015833169 | DTXSID2

Specifications & Purity

≥98%(T)

Storage

Room temperature, Argon charged, Desiccated, Cool

Shipped In

Normal

Purity

≥98%(T)

Names and Identifiers

• Canonical Smiles: CCO[Si](CCC[N+](C)(C)C)(OCC)OCC.[Cl-]
• IUPAC Name: trimethyl(3-triethoxysilylpropyl)azanium;chloride
• InChIKey: JMCRETWEZLOFQT-UHFFFAOYSA-M
• INCHI: 1S/C12H30NO3Si.ClH/c1-7-14-17(15-8-2,16-9-3)12-10-11-13(4,5)6;/h7-12H2,1-6H3;1H/q+1;/p-1
• Isomeric SMILES: CCO[Si](CCC[N+](C)(C)C)(OCC)OCC.[Cl-]
• PubChem CID: 23002981
• Molecular Weight: 299.91
• Reaxy-Rn: 11323293

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 Organooxygen compounds Organic chloride salts Hydrocarbon derivatives Amines Organic cations
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Trialkoxysilane - Quaternary ammonium salt - Tetraalkylammonium salt - Silyl ether - Organic metalloid salt - Organoheterosilane - Amine - Hydrocarbon derivative - Organic chloride salt - Organic salt - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic cation - 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

Chemical and Physical Properties

• Solubility: Soluble in water.
• Sensitivity: Moisture sensitive
• Molecular Weight: 299.910 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 10
• Exact Mass: 299.168 Da
• Monoisotopic Mass: 299.168 Da
• Topological Polar Surface Area: 27.700 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 178.000
• 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

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