Potassium(2,3-dihydro-1H-inden-2-yl)teifluoroborate , CAS No.50987184

CAS: 50987184 Cat. No.: P988863 Peso molecular: 184.980

Storage

Room temperature

Specifications

Condiciones de almacenamiento de almacenamiento

Room temperature

Nombres e identificadores

• Sonrisas canónicas: [B-](C1CC2=CC=CC=C2C1)(F)(F)F
• IUPAC Name: 2,3-dihydro-1H-inden-2-yl(trifluoro)boranuide
• InChIKey: VJAKEOZJTASTPR-UHFFFAOYSA-N
• INCHI: 1S/C9H9BF3/c11-10(12,13)9-5-7-3-1-2-4-8(7)6-9/h1-4,9H,5-6H2/q-1
• Peso molecular: 184.980

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Indanes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Indanes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Indanes
• Alternative Parents: Boronic acid derivatives Alkylhaloboranes Organic metalloid salts Monoalkylboranes Hydrocarbon derivatives Organic anions
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Indane - Alkylhaloborane - Boronic acid derivative - Organic metalloid salt - Monoalkylborane - Alkylborane - Hydrocarbon derivative - Organic metalloid moeity - Organic anion - Aromatic homopolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as indanes. These are compounds containing an indane moiety, which consists of a cyclopentane fused 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

Propiedades químicas y físicas

• Peso molecular: 184.980 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 185.075 Da
• Monoisotopic Mass: 185.075 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 13
• Formal Charge: -1
• Complexity: 176.000
• 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: 1

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