Trimethylvinylammonium Bromide - ≥97%(T) , CAS No.10603-92-6

CAS: 10603-92-6 Cat. No.: T161689 Molecular Weight: 166.06 EC Number: 234-227-3 PubChem CID: 25426

GRADE & PURITY ≥97%(T)

Synonyms

AS-81760 | Trimethylvinylammonium bromide | TRIMETHYLVINYLAMMONIUMBROMIDE | ETHENYLTRIMETHYLAZANIUM BROMIDE | Ethenaminium,N,N-trimethyl-, bromide | SCHEMBL2351013 | Neurine bromide | AMMONIUM, TRIMETHYLVINYL-, BROMIDE | N,N,N-Trimethylethenaminium bromid

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Synonyms

AS-81760 | Trimethylvinylammonium bromide | TRIMETHYLVINYLAMMONIUMBROMIDE | ETHENYLTRIMETHYLAZANIUM BROMIDE | Ethenaminium, N, N-trimethyl-, bromide | SCHEMBL2351013 | Neurine bromide | AMMONIUM, TRIMETHYLVINYL-, BROMIDE | N, N, N-Trimethylethenaminium bromid

Specifications & Purity

≥97%(T)

Storage

Argon charged, Room temperature

Shipped In

Normal

Purity

≥97%(T)

Names and Identifiers

• Pubchem Sid: 504753304
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504753304
• Canonical Smiles: C[N+](C)(C)C=C.[Br-]
• IUPAC Name: ethenyl(trimethyl)azanium;bromide
• InChIKey: IDVSELVVGYIOEX-UHFFFAOYSA-M
• INCHI: 1S/C5H12N.BrH/c1-5-6(2,3)4;/h5H,1H2,2-4H3;1H/q+1;/p-1
• Isomeric SMILES: C[N+](C)(C)C=C.[Br-]
• RTECS: BT3675000
• PubChem CID: 25426
• Molecular Weight: 166.06
• Reaxy-Rn: 3914073

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Class Organonitrogen compounds
      • Subclass Quaternary ammonium salts

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Class: Organonitrogen compounds
• Subclass: Quaternary ammonium salts
• Intermediate Tree Nodes: Not available
• Direct Parent: Quaternary ammonium salts
• Alternative Parents: Allylamines Organopnictogen compounds Organic bromide salts Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Quaternary ammonium salt - Allylamine - Organopnictogen compound - Hydrocarbon derivative - Organic bromide salt - Organic salt - Amine - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as quaternary ammonium salts. These are compounds containing positively charged polyatomic ion of the structure NR4+, R being an alkyl group or an aryl 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

• Sensitivity: Hygroscopic
• Molecular Weight: 166.060 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 165.015 Da
• Monoisotopic Mass: 165.015 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 49.400
• 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