1,1,1,3,3,3-Hexakis(dimethylamino)diphosphazenium tetrafluoroborate - ≥98%(T) , CAS No.137334-98-6

CAS: 137334-98-6 Cat. No.: H465358 Molecular Weight: 427.21 EC Number: 627-963-5 PubChem CID: 11811992

GRADE & PURITY ≥98%(T)

Synonyms

DTXSID70473328 | Bis[tris(dimethylamino)phosphoranylidene]ammonium tetrafluoroborate | 1,1,1,3,3,3-Hexakis(dimethylamino)diphos-phazenium tetrafluoroborate,98% | J-007001 | Phosphazenium tetrafluoroborate P2-BF4 | 1,1,1,3,3,3-Hexakis(dimethylamino)diphosp

Storage

Room temperature

Overview

Description

Phosphazene Bases: a Family of Extremely Strong, Non-Ionic, Non-Charged Nitrogen–Bases

Specifications

Synonyms

DTXSID70473328 | Bis[tris(dimethylamino)phosphoranylidene]ammonium tetrafluoroborate | 1, 1, 1, 3, 3, 3-Hexakis(dimethylamino)diphos-phazenium tetrafluoroborate, 98% | J-007001 | Phosphazenium tetrafluoroborate P2-BF4 | 1, 1, 1, 3, 3, 3-Hexakis(dimethylamino)diphosp

Specifications & Purity

≥98%(T)

Storage

Room temperature

Purity

≥98%(T)

Names and Identifiers

• Canonical Smiles: [B-](F)(F)(F)F.CN(C)P(=N[P+](N(C)C)(N(C)C)N(C)C)(N(C)C)N(C)C
• IUPAC Name: tris(dimethylamino)-[[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium;tetrafluoroborate
• InChIKey: DPIDWCQJGWFENO-UHFFFAOYSA-N
• INCHI: 1S/C12H36N7P2.BF4/c1-14(2)20(15(3)4,16(5)6)13-21(17(7)8,18(9)10)19(11)12;2-1(3,4)5/h1-12H3;/q+1;-1
• Isomeric SMILES: [B-](F)(F)(F)F.CN(C)P(=N[P+](N(C)C)(N(C)C)N(C)C)(N(C)C)N(C)C
• WGK Germany: 3
• PubChem CID: 11811992
• Molecular Weight: 427.21

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic salts
• Class: 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
• Description: 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

Chemical and Physical Properties

• Molecular Weight: 427.220 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 7
• Exact Mass: 427.254 Da
• Monoisotopic Mass: 427.254 Da
• Topological Polar Surface Area: 31.800 Ų
• Heavy Atom Count: 26
• Formal Charge: 0
• Complexity: 312.000
• 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