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Bis(4-tert-butylphenyl)iodonium Trifluoromethanesulfonate - 98%, high purity , CAS No.84563-54-2

COA

Grade & Purity:

≥98%

Cas Number: 84563-54-2
Molecular Weight: 542.4
PubChem CID: 2734848
PubChem SID: 488192676

In stock

Item Number

B152266

Grouped product items
SKU	Size	Availability	Price
B152266-250mg	250mg	4	$14.90
B152266-1g	1g	4	$47.90
B152266-5g	5g	1	$164.90

View related series

Fluorine-containing compounds (56) Photoinitiator (5)

Basic Description

Synonyms	Bis[4-(tert-butyl)phenyl]iodonium Trifluoromethanesulfonate \| DtBPIT \| AKOS015853002 \| AS-10495 \| SCHEMBL36627 \| B2381 \| C21H26F3IO3S \| D81809 \| DTXSID80370536 \| bis(p-tert-butylphenyl)iodonium trifluoromethanesulfonate \| Bis(4-tert-butylphenyl)iodonium t
Specifications & Purity	≥98%
Storage Temp	Argon charged
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Phenylpropanes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Phenylpropanes
Intermediate Tree Nodes	Not available
Direct Parent	Phenylpropanes
Alternative Parents	Iodobenzenes Aryl iodides Organoiodides Organic salts Hydrocarbon derivatives
Molecular Framework	Not available
Substituents	Phenylpropane - Iodobenzene - Halobenzene - Aryl iodide - Aryl halide - Hydrocarbon derivative - Organic salt - Organoiodide - Organohalogen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenylpropanes. These are organic compounds containing a phenylpropane moiety.
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	488192676
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488192676
IUPAC Name	bis(4-tert-butylphenyl)iodanium;trifluoromethanesulfonate
INCHI	InChI=1S/C20H26I.CHF3O3S/c1-19(2,3)15-7-11-17(12-8-15)21-18-13-9-16(10-14-18)20(4,5)6;2-1(3,4)8(5,6)7/h7-14H,1-6H3;(H,5,6,7)/q+1;/p-1
InChIKey	VGZKCAUAQHHGDK-UHFFFAOYSA-M
Smiles	CC(C)(C)C1=CC=C(C=C1)[I+]C2=CC=C(C=C2)C(C)(C)C.C(F)(F)(F)S(=O)(=O)[O-]
Isomeric SMILES	CC(C)(C)C1=CC=C(C=C1)[I+]C2=CC=C(C=C2)C(C)(C)C.C(F)(F)(F)S(=O)(=O)[O-]
PubChem CID	2734848
Molecular Weight	542.4

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

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

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

8 results found

Lot Number	Certificate Type	Date	Item
D2418616	Certificate of Analysis	Apr 07, 2024	B152266
D2418621	Certificate of Analysis	Apr 07, 2024	B152266
B2321560	Certificate of Analysis	Dec 20, 2022	B152266
B2321558	Certificate of Analysis	Dec 20, 2022	B152266
B2321563	Certificate of Analysis	Dec 20, 2022	B152266
B2321479	Certificate of Analysis	Dec 20, 2022	B152266
B2321393	Certificate of Analysis	Dec 20, 2022	B152266
B2321160	Certificate of Analysis	Dec 20, 2022	B152266

Chemical and Physical Properties

Solubility	ethyl lactate: ~25%；γ-butyrolactone: ~50%；PGMEA: ~50%
Sensitivity	Moisture sensitive
Melt Point(°C)	162-166 °C
Molecular Weight	542.400 g/mol
XLogP3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	4
Exact Mass	542.06 Da
Monoisotopic Mass	542.06 Da
Topological Polar Surface Area	65.600 Å²
Heavy Atom Count	29
Formal Charge	0
Complexity	416.000
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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