Tetrabutylammonium fluoride solution - 75% in water , CAS No.429-41-4

CAS: 429-41-4 Cat. No.: T106822 分子式: [CH₃(CH₂)₃]₄NF 分子量: 261.46 Beilstein Registry Number: 3762762 EC番号: 207-057-2

GRADE & PURITY 75% in water

Synonyms

tetrabutylammonium fluride | 1-Butanaminium, N,N,N-tributyl-, fluoride | 1-Butanaminium, N,N,N-tributyl-, fluoride (1:1) | T1125 | Tetrabutyammonium fluoride | tetra butyl ammonium fluoride | tetrabuthylammonium fluoride | tetrabuthyl-ammonium fluoride |

Storage

Room temperature

Shipped In

Normal

Specifications

同義語

tetrabutylammonium fluride | 1-Butanaminium, N,N,N-tributyl-, fluoride | 1-Butanaminium, N,N,N-tributyl-, fluoride (1:1) | T1125 | Tetrabutyammonium fluoride | tetra butyl ammonium fluoride | tetrabuthylammonium fluoride | tetrabuthyl-ammonium fluoride |

仕様と純度

75% in water

保管条件

Room temperature

入荷

Normal

名前と識別子

パブケム・シド

528771014

カノニカル・スマイル

[F-].CCCC[N+](CCCC)(CCCC)CCCC

InChIKey

FPGGTKZVZWFYPV-UHFFFAOYSA-M

INCHI

1S/C16H36N.FH/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;/h5-16H2,1-4H3;1H/q+1;/p-1

異性体SMILES

CCCC[N+](CCCC)(CCCC)CCCC.[F-]

WGKドイツ

3

UN番号

1993

包装グループ

II

分子量

261.46

Beilstein

3762762

Reaxy-Rn

3570522

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• 分類: Organonitrogen compounds
• Subclass: Quaternary ammonium salts
• Intermediate Tree Nodes: Not available
• Direct Parent: Tetraalkylammonium salts
• Alternative Parents: Organopnictogen compounds Organic salts Hydrocarbon derivatives Amines
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Tetraalkylammonium salt - Organopnictogen compound - Hydrocarbon derivative - Organic salt - Amine - Aliphatic acyclic compound
• 説明: This compound belongs to the class of organic compounds known as tetraalkylammonium salts. These are organonitrogen compounds containing a quaternary ammonium substituted with four alkyl chains.
• External Descriptors: fluoride salt - tetrabutylammonium salt

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

関連ターゲット（非人間）

Staphylococcus epidermidis (22802 Activities)

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作用メカニズム

化学的性質と物理的性質

• 引火点（°F）: 1.4 °F
• 引火点（°C）: -17℃
• 融点（°C）: 62-63°C
• 分子量: 261.459 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 12
• Exact Mass: 261.283 Da
• Monoisotopic Mass: 261.283 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 116.000
• 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