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Bis(4-tert-butylphenyl)iodonium p-toluenesulfonate - electronic grade, ≥99% trace metals basis, high purity , CAS No.131717-99-2

COA

Grade & Purity:

electronic grade

≥99% metals basis

Cas Number: 131717-99-2
Molecular Weight: 564.52
MDL number: MFCD02683472
PubChem CID: 16216932

In stock

Item Number

B476343

Grouped product items
SKU	Size	Availability	Price
B476343-250mg	250mg	3	$129.90
B476343-1g	1g	2	$427.90
B476343-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,922.90

Basic Description

Specifications & Purity	electronic grade, ≥99% metals basis
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.
Grade	electronic grade
Product Description	Description Cationic photoinitiator. Photoacid generator.

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzenesulfonic acids and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	p-Methylbenzenesulfonates
Alternative Parents	Tosyl compounds Phenylpropanes Benzenesulfonyl compounds 1-sulfo,2-unsubstituted aromatic compounds Iodobenzenes Aryl iodides Sulfonyls Organosulfonic acids Organoiodides Organic salts Organic oxides Hydrocarbon derivatives
Molecular Framework	Not available
Substituents	P-methylbenzenesulfonate - Tosyl compound - Benzenesulfonyl group - 1-sulfo,2-unsubstituted aromatic compound - Phenylpropane - Arylsulfonic acid or derivatives - Toluene - Iodobenzene - Halobenzene - Aryl iodide - Aryl halide - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organosulfur compound - Organoiodide - Organohalogen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as p-methylbenzenesulfonates. These are benzenesulfonic acids (or derivative thereof) carrying a methyl group at the para- position.
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

IUPAC Name	bis(4-tert-butylphenyl)iodanium;4-methylbenzenesulfonate
INCHI	InChI=1S/C20H26I.C7H8O3S/c1-19(2,3)15-7-11-17(12-8-15)21-18-13-9-16(10-14-18)20(4,5)6;1-6-2-4-7(5-3-6)11(8,9)10/h7-14H,1-6H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1
InChIKey	UEJFJTOGXLEPIV-UHFFFAOYSA-M
Smiles	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC(C)(C)C1=CC=C(C=C1)[I+]C2=CC=C(C=C2)C(C)(C)C
Isomeric SMILES	CC1=CC=C(C=C1)S(=O)(=O)[O-].CC(C)(C)C1=CC=C(C=C1)[I+]C2=CC=C(C=C2)C(C)(C)C
PubChem CID	16216932
Molecular Weight	564.52

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

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

Analytical Chart:

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3 results found

Lot Number	Certificate Type	Date	Item
L2307307	Certificate of Analysis	Nov 21, 2023	B476343
L2307299	Certificate of Analysis	Nov 21, 2023	B476343
L2307308	Certificate of Analysis	Nov 21, 2023	B476343

Chemical and Physical Properties

Solubility	PGMEA: <1%γ-butyrolactone: ~10%ethyl lactate: ~10%
Sensitivity	light sensitive; moisture sensitive;heat sensitive
Flash Point(°F)	Not applicable
Flash Point(°C)	Not applicable
Melt Point(°C)	237-240℃ (lit.)
Molecular Weight	564.500 g/mol
XLogP3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	564.12 Da
Monoisotopic Mass	564.12 Da
Topological Polar Surface Area	65.600 Å²
Heavy Atom Count	32
Formal Charge	0
Complexity	465.000
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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