XtalFluor-E - Reagent grade , CAS No.63517-29-3

CAS: 63517-29-3 Cat. No.: X139125 分子式: C₄H₁₀BF₆NS 分子量: 229 EC番号: 687-130-7 PubChem CID: 44517918

グレード＆純度 Reagent Grade

Synonyms

H10830 | MFCD15144877 | SY020381 | AKOS027470099 | diethylamino(difluoro)sulfanium;tetrafluoroborate | XTALFLUOR-E(R) | (difluoro-lambda4-sulfanylidene)(diethyl)ammonium tetrafluoroborate | AMY1278 | (Diethylamino)(difluoro)sulfanium tetrafluoroborate | D

Storage

Protected from light,Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

概要

Convenient crystalline highly chemoselective deoxofluorination reagent with a broad substrate scope.Deoxofluorination reagent with a better safety profile, that doesn′t generate corrosive HF which makes it suitable for use in standard borosilicate vessels, and does not react violently with water

仕様

同義語

H10830 | MFCD15144877 | SY020381 | AKOS027470099 | diethylamino(difluoro)sulfanium;tetrafluoroborate | XTALFLUOR-E(R) | (difluoro-lambda4-sulfanylidene)(diethyl)ammonium tetrafluoroborate | AMY1278 | (Diethylamino)(difluoro)sulfanium tetrafluoroborate | D

仕様と純度

Reagent Grade

保管条件

Protected from light,Store at -20°C,Argon charged

入荷

Ice chest + Ice pads

この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。

等級

Reagent Grade

名前と識別子

パブケム・シド

488200992

パブケム・シド・ウル

https://pubchem.ncbi.nlm.nih.gov/substance/488200992

カノニカル・スマイル

[B-](F)(F)(F)F.CCN(CC)[S+](F)F

IUPAC Name

diethylamino(difluoro)sulfanium;tetrafluoroborate

InChIKey

YLNKFQWRRIXZPJ-UHFFFAOYSA-N

INCHI

1S/C4H10F2NS.BF4/c1-3-7(4-2)8(5)6;2-1(3,4)5/h3-4H2,1-2H3;/q+1;-1

異性体SMILES

[B-](F)(F)(F)F.CCN(CC)[S+](F)F

WGKドイツ

3

PubChem CID

44517918

分子量

229

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic salts
    • 分類 Organic metal salts
      • Subclass Organic metalloid salts

• Kingdom: Organic compounds
• Superclass: Organic salts
• 分類: Organic metal salts
• Subclass: Organic metalloid salts
• Intermediate Tree Nodes: Not available
• Direct Parent: Organic metalloid salts
• Alternative Parents: Organonitrogen compounds Hydrocarbon derivatives Organic cations
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organic metalloid salt - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organic cation - Aliphatic acyclic compound
• 説明: This compound belongs to the class of organic compounds known as organic metalloid salts. These are organic salt compounds containing a metalloid atom in its ionic form.
• 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

化学的性質と物理的性質

• 感度: Light & Moisture sensitive
• 分子量: 229.000 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 2
• Exact Mass: 229.053 Da
• Monoisotopic Mass: 229.053 Da
• Topological Polar Surface Area: 4.200 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 75.100
• 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