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Bis(4-tert-butylphenyl)iodonium perfluoro-1-butanesulfonate - electronic grade, ≥99%, high purity , CAS No.194999-85-4

COA

Grade & Purity:

electronic grade

≥99%

Cas Number: 194999-85-4
Molecular Weight: 692.42
MDL number: MFCD02683473
PubChem CID: 16216933
PubChem SID: 488199209

In stock

Item Number

B476350

Grouped product items
SKU	Size	Availability	Price	Qty
B476350-1g	1g	3	$665.90
B476350-5g	5g	5	$1,467.90

Basic Description

Synonyms	Bis(4-tert-butylphenyl)iodonium perfluoro-1-butanesulfonate \| DJBAOXYQCAKLPH-UHFFFAOYSA-M \| Bis(4-tert-butylphenyl)iodonium Nonafluoro-1-butanesulfonate \| Di(4-tert-butylphenyl)iodonium perfluorobutanesulfonate \| DTXSID10584184 \| MFCD02683473 \| BIS(4-TERT
Specifications & Purity	electronic grade, ≥99%
Storage Temp	Protected from light,Argon charged
Shipped In	Normal
Grade	electronic grade
Product Description	Description Cationic photoinitiator. Photoacid generator.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organohalogen compounds
  - Class Alkyl halides
    - Subclass Alkyl fluorides

Kingdom	Organic compounds
Superclass	Organohalogen compounds
Class	Alkyl halides
Subclass	Alkyl fluorides
Intermediate Tree Nodes	Not available
Direct Parent	Perfluoroalkyl sulfonic acid and derivatives
Alternative Parents	Phenylpropanes Iodobenzenes Aryl iodides Sulfonyls Organosulfonic acids Alkanesulfonic acids Organoiodides Organofluorides Organic salts Organic oxides Hydrocarbon derivatives
Molecular Framework	Not available
Substituents	Perfluoroalkyl sulfonic acid or derivatives - Phenylpropane - Halobenzene - Iodobenzene - Aryl halide - Aryl iodide - Monocyclic benzene moiety - Benzenoid - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Sulfonyl - Alkanesulfonic acid - Hydrocarbon derivative - Organosulfur compound - Organoiodide - Organofluoride - Organic oxide - Organic oxygen compound - Organic salt - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as perfluoroalkyl sulfonic acid and derivatives. These are organic compounds containing an alkyl chain attached to the sulfur of a sulfonic acid group (or a derivative thereof), where all hydrogens of the alkyl chain are replaced by fluorine atoms.
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	488199209
IUPAC Name	bis(4-tert-butylphenyl)iodanium;1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate
INCHI	InChI=1S/C20H26I.C4HF9O3S/c1-19(2,3)15-7-11-17(12-8-15)21-18-13-9-16(10-14-18)20(4,5)6;5-1(6,3(9,10)11)2(7,8)4(12,13)17(14,15)16/h7-14H,1-6H3;(H,14,15,16)/q+1;/p-1
InChIKey	DJBAOXYQCAKLPH-UHFFFAOYSA-M
Smiles	CC(C)(C)C1=CC=C(C=C1)[I+]C2=CC=C(C=C2)C(C)(C)C.C(C(C(F)(F)S(=O)(=O)[O-])(F)F)(C(F)(F)F)(F)F
Isomeric SMILES	CC(C)(C)C1=CC=C(C=C1)[I+]C2=CC=C(C=C2)C(C)(C)C.C(C(C(F)(F)S(=O)(=O)[O-])(F)F)(C(F)(F)F)(F)F
PubChem CID	16216933
Molecular Weight	692.42

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

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

Analytical Chart:

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4 results found

Lot Number	Certificate Type	Date	Item
E2316328	Certificate of Analysis	Mar 22, 2023	B476350
E2316335	Certificate of Analysis	Mar 22, 2023	B476350
E2316331	Certificate of Analysis	Mar 22, 2023	B476350
E2316350	Certificate of Analysis	Mar 22, 2023	B476350

Chemical and Physical Properties

Solubility	PGMEA: ~40%ethyl lactate: ~55%γ-butyrolactone: ~65%
Sensitivity	Moisture sensitive；Light sensitive；Air sensitive
Flash Point(°F)	Not applicable
Flash Point(°C)	Not applicable
Melt Point(°C)	175-177℃ (lit.)
Molecular Weight	692.400 g/mol
XLogP3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	12
Rotatable Bond Count	6
Exact Mass	692.05 Da
Monoisotopic Mass	692.05 Da
Topological Polar Surface Area	65.600 Å²
Heavy Atom Count	38
Formal Charge	0
Complexity	646.000
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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