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1,3-Bis(2,4,6-trimethylphenyl)imidazolium tetrafluoroborate - 98%, high purity , CAS No.286014-53-7

COA

Grade & Purity:

≥98%

Cas Number: 286014-53-7
Molecular Weight: 392.24
PubChem CID: 15535038
PubChem SID: 504767883

In stock

Item Number

D588571

Grouped product items
SKU	Size	Availability	Price
D588571-250mg	250mg	2	$23.90
D588571-1g	1g	2	$64.90
D588571-5g	5g	2	$224.90

Basic Description

Specifications & Purity	≥98%
Storage Temp	Store at 2-8°C,Protected from light,Argon charged
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Azoles
    - Subclass Imidazoles
      - Level5 Substituted imidazoles
        Level6 Phenylimidazoles

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Azoles
Subclass	Imidazoles
Intermediate Tree Nodes	Substituted imidazoles
Direct Parent	Phenylimidazoles
Alternative Parents	N-substituted imidazoles Benzene and substituted derivatives Heteroaromatic compounds Organic metalloid salts Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives Organic cations
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	1-phenylimidazole - Benzenoid - N-substituted imidazole - Monocyclic benzene moiety - Heteroaromatic compound - Azacycle - Organic metalloid salt - Organic nitrogen compound - Hydrocarbon derivative - Organic salt - Organonitrogen compound - Organic cation - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenylimidazoles. These are polycyclic aromatic compounds containing a benzene ring linked to an imidazole ring through a CC or CN bond.
External Descriptors	Not available
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

Names and Identifiers

Pubchem Sid	504767883
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504767883
IUPAC Name	1,3-bis(2,4,6-trimethylphenyl)imidazol-1-ium;tetrafluoroborate
INCHI	InChI=1S/C21H25N2.BF4/c1-14-9-16(3)20(17(4)10-14)22-7-8-23(13-22)21-18(5)11-15(2)12-19(21)6;2-1(3,4)5/h7-13H,1-6H3;/q+1;-1
InChIKey	VMNIOVNFFKZSAL-UHFFFAOYSA-N
Smiles	[B-](F)(F)(F)F.CC1=CC(=C(C(=C1)C)N2C=C[N+](=C2)C3=C(C=C(C=C3C)C)C)C
Isomeric SMILES	[B-](F)(F)(F)F.CC1=CC(=C(C(=C1)C)N2C=C[N+](=C2)C3=C(C=C(C=C3C)C)C)C
PubChem CID	15535038
Molecular Weight	392.24

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

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6 results found

Lot Number	Certificate Type	Date	Item
J2319119	Certificate of Analysis	Sep 25, 2023	D588571
J2319117	Certificate of Analysis	Sep 25, 2023	D588571
J2319115	Certificate of Analysis	Sep 25, 2023	D588571
J2319118	Certificate of Analysis	Sep 25, 2023	D588571
J2319114	Certificate of Analysis	Sep 25, 2023	D588571
J2319116	Certificate of Analysis	Sep 25, 2023	D588571

Chemical and Physical Properties

Sensitivity	Light and moisture sensitive
Molecular Weight	392.200 g/mol
XLogP3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Exact Mass	392.205 Da
Monoisotopic Mass	392.205 Da
Topological Polar Surface Area	8.800 Å²
Heavy Atom Count	28
Formal Charge	0
Complexity	354.000
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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