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4-Iodobenzenesulfonyl chloride - 97%, high purity , CAS No.98-61-3

1 Citations

COA

Grade & Purity:

≥97%

Cas Number: 98-61-3
Molecular Weight: 302.52
EC Number: 202-686-9
MDL number: MFCD00007441
PubChem CID: 7399

In stock

Item Number

I124720

Grouped product items
SKU	Size	Availability	Price
I124720-1g	1g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$11.90
I124720-5g	5g	3	$44.90
I124720-25g	25g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$135.90
I124720-100g	100g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$489.90

View related series

Non heterocyclic block (8163) Sulfur containing compounds (986)

Basic Description

Synonyms	4-iodobenzenesulphonylchloride \| UNII-MVL274EZOG \| H11891 \| AMY10954 \| NSC77079 \| NSC-77079 \| MFCD00007441 \| 4-iodophenylsulphonyl chloride \| P-IODOBENZENESULPHONYL CHLORIDE \| W-100072 \| p-Iodobenzenesulfonyl chloride \| I0051 \| 4-Iodo benzenesulfonyl chlo
Specifications & Purity	≥97%
Storage Temp	Protected from light,Argon charged
Shipped In	Normal
Product Description	The reaction of 4-iodobenzenesulfonyl chloride (pipsyl chloride) with peptides under various conditions has been studied

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Benzenesulfonyl compounds
      - Level5 Benzenesulfonyl halides
        Level6 Benzenesulfonyl chlorides

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzenesulfonyl compounds
Intermediate Tree Nodes	Benzenesulfonyl halides
Direct Parent	Benzenesulfonyl chlorides
Alternative Parents	Iodobenzenes Aryl iodides Sulfonyls Sulfonyl chlorides Organosulfonic acids and derivatives Organoiodides Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Benzenesulfonyl chloride - Halobenzene - Iodobenzene - Aryl halide - Aryl iodide - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl chloride - Sulfonyl halide - Organoiodide - Organohalogen compound - Organosulfur compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as benzenesulfonyl chlorides. These are aromatic compounds containing a benzenesulfonyl group, where the sulfonyl moiety is singly boned to a chloride atom.
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	4-iodobenzenesulfonyl chloride
INCHI	InChI=1S/C6H4ClIO2S/c7-11(9,10)6-3-1-5(8)2-4-6/h1-4H
InChIKey	POXFXTSTVWDWIR-UHFFFAOYSA-N
Smiles	C1=CC(=CC=C1S(=O)(=O)Cl)I
Isomeric SMILES	C1=CC(=CC=C1S(=O)(=O)Cl)I
WGK Germany	3
Molecular Weight	302.52
Reaxy-Rn	2691661
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2691661&ln=

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

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

Analytical Chart:

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5 results found

Lot Number	Certificate Type	Date	Item
E2204151	Certificate of Analysis	Feb 21, 2024	I124720
E2204159	Certificate of Analysis	Feb 21, 2024	I124720
E2204160	Certificate of Analysis	Feb 21, 2024	I124720
D2101058	Certificate of Analysis	Jan 13, 2023	I124720
D2101059	Certificate of Analysis	Jan 13, 2023	I124720

Chemical and Physical Properties

Solubility	Reacts with water
Sensitivity	Moisture & Light Sensitive
Melt Point(°C)	80-82°C
Molecular Weight	302.520 g/mol
XLogP3	3.000
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	301.867 Da
Monoisotopic Mass	301.867 Da
Topological Polar Surface Area	42.500 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	213.000
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	1

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