Sodium Tetrakis(4-fluorophenyl)borate Hydrate [Precipitation reagent for Cs and titrimetric reagent for nonionic surfactants] - ≥97%(NT) , CAS No.25776-12-9

CAS: 25776-12-9 Cat. No.: S489042 Molecular Weight: 414.19 EC Number: 677-143-6 PubChem CID: 23681137

GRADE & PURITY ≥97%(NT)

Synonyms

sodium;tetrakis(4-fluorophenyl)boranuide | Sodium tetrankis(4-fluorophenyl)borate | Sodium tetrakis(4-fluorophenyl)borate(1-) | SODIUM TETRAKIS(4-FLUOROPHENYL)BORATE HYDRATE [PRECIPITATION REAGENT FOR CS AND TITRIMETRIC REAGENT FOR NONIONIC SURFACTANTS] |

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Synonyms

sodium;tetrakis(4-fluorophenyl)boranuide | Sodium tetrankis(4-fluorophenyl)borate | Sodium tetrakis(4-fluorophenyl)borate(1-) | SODIUM TETRAKIS(4-FLUOROPHENYL)BORATE HYDRATE [PRECIPITATION REAGENT FOR CS AND TITRIMETRIC REAGENT FOR NONIONIC SURFACTANTS] |

Specifications & Purity

≥97%(NT)

Storage

Store at 2-8°C

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥97%(NT)

Names and Identifiers

• Canonical Smiles: [B-](C1=CC=C(C=C1)F)(C2=CC=C(C=C2)F)(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F.[Na+]
• IUPAC Name: sodium;tetrakis(4-fluorophenyl)boranuide
• InChIKey: SHCUEWMHZQGOBL-UHFFFAOYSA-N
• INCHI: 1S/C24H16BF4.Na/c26-21-9-1-17(2-10-21)25(18-3-11-22(27)12-4-18,19-5-13-23(28)14-6-19)20-7-15-24(29)16-8-20;/h1-16H;/q-1;+1
• Isomeric SMILES: [B-](C1=CC=C(C=C1)F)(C2=CC=C(C=C2)F)(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F.[Na+]
• PubChem CID: 23681137
• Molecular Weight: 414.19
• Reaxy-Rn: 4285808

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Benzene and substituted derivatives
      • Subclass Halobenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Benzene and substituted derivatives
• Subclass: Halobenzenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Fluorobenzenes
• Alternative Parents: Aryl fluorides Organic metalloid salts Organic metal halides Organometalloid compounds Organofluorides Organic sodium salts Hydrocarbon derivatives Organic cations
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Fluorobenzene - Aryl halide - Aryl fluoride - Organic metal halide - Organic alkali metal salt - Organic metalloid salt - Hydrocarbon derivative - Organic sodium salt - Organic salt - Organofluoride - Organic metalloid moeity - Organohalogen compound - Organic cation - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as fluorobenzenes. These are compounds containing one or more fluorine atoms attached to a benzene ring.
• 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: Hygroscopic,Heat Sensitive
• Molecular Weight: 414.200 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 414.118 Da
• Monoisotopic Mass: 414.118 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 30
• Formal Charge: 0
• Complexity: 410.000
• 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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