Potassium (4-bromophenyl)trifluoroborate - ≥98% , CAS No.374564-35-9

CAS: 374564-35-9 Cat. No.: P184099 Molecular Weight: 262.9 EC Number: 624-815-1 PubChem CID: 23674779

GRADE & PURITY ≥98%

Synonyms

EN300-3172249 | AM86917 | A823667 | potassium;(4-bromophenyl)-trifluoroboranuide | MFCD02093978 | Potassium 4-bromophenyl trifluoroborate | SCHEMBL9894268 | AKOS015910171 | DTXSID90635486 | Potassium 4-bromophenyltrifluoroborate | AS-2314 | Potassium (4-b

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

EN300-3172249 | AM86917 | A823667 | potassium;(4-bromophenyl)-trifluoroboranuide | MFCD02093978 | Potassium 4-bromophenyl trifluoroborate | SCHEMBL9894268 | AKOS015910171 | DTXSID90635486 | Potassium 4-bromophenyltrifluoroborate | AS-2314 | Potassium (4-b

Specifications & Purity

≥98%

Storage

Room temperature

Shipped In

Normal

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 504769596
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504769596
• Canonical Smiles: [B-](C1=CC=C(C=C1)Br)(F)(F)F.[K+]
• IUPAC Name: potassium;(4-bromophenyl)-trifluoroboranuide
• InChIKey: YTSKPQQWISZEQO-UHFFFAOYSA-N
• INCHI: 1S/C6H4BBrF3.K/c8-6-3-1-5(2-4-6)7(9,10)11;/h1-4H;/q-1;+1
• Isomeric SMILES: [B-](C1=CC=C(C=C1)Br)(F)(F)F.[K+]
• PubChem CID: 23674779
• Molecular Weight: 262.9

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: Bromobenzenes
• Alternative Parents: Aryl bromides Boronic acid derivatives Organic metalloid salts Organic metal halides Organometalloid compounds Organobromides Organic potassium salts Hydrocarbon derivatives Organic cations
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Bromobenzene - Aryl halide - Aryl bromide - Boronic acid derivative - Organic metal halide - Organic alkali metal salt - Organic metalloid salt - Hydrocarbon derivative - Organic potassium salt - Organic salt - Organobromide - Organic metalloid moeity - Organohalogen compound - Organic cation - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as bromobenzenes. These are organic compounds containing a bromine atom 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
• Melt Point(°C): 250 °C
• Molecular Weight: 262.910 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 261.918 Da
• Monoisotopic Mass: 261.918 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 133.000
• 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