Tel:

Email:

EN
Cat. No. Size / Unit Price Qty
CS-W001157 4
Total: USD 88.00

4-Iodobenzonitrile

  • CAS No. 3058-39-7

  • Cat. No. CS-W009114
  • Purity≥98%
  • MDL No.MFCD00051310

*For research and further manufacturing use only, not for direct human use.

4-Iodobenzonitrile|CS-W009114

Structure of 3058-39-7

Please choose your location and provide accurate information for you
Size Stock
Price Quantity

* Please select Quantity before adding items.

General Information

  • CAS No. 3058-39-7
  • Cat. No. CS-W009114
  • Purity ≥98%
  • MDL No. MFCD00051310
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₄IN
  • Molecular Weight 229.02
  • Synonym(s) p-Iodobenzonitrile
  • SMILES N#CC(C=C1)=CC=C1I

Description

4-Iodobenzonitrile may be used in the synthesis of the following:ethyl-4-cyano-4-nitro[1,1-biphenyl]-2-carboxylate via a multi-step reaction process2-(4-cyanophenyl)tellurophene obtained via Stille coupling with tellurophene2,5-bis(4-cyanophenyl)tellurophene obtained via Stille coupling with 2,5-bis(trimethylstannyl)telluropheneethyl-4-cyano-6-{[(E)-phenylmethylidene]amino}[1,1-biphenyl]-3-carboxylate via a multi-step reaction process

Application

4-Iodobenzonitrile serves as a versatile building block in cross-coupling chemistry, enabling efficient Suzuki, Stille, and Negishi reactions due to its stable iodide functionality and electron-withdrawing nitrile group. The molecule exhibits excellent bench stability, facilitates straightforward purification, and demonstrates broad functional group tolerance, making it ideal for constructing complex aryl scaffolds in medicinal chemistry and materials science applications.

Synthesis

  • Route1

    References

    • Xiang, Yanqiao; Caron, Pierre-Yves; Lillie, Brett M.; Vaidyanathan, Rajappa Organic Process Research and Development, 2008 , vol. 12, # 1 p. 116 - 119
  • Route2

    References

    • Niu, Liting; Zhang, Hao; Yang, Haijun; Fu, Hua Synlett, 2014 , vol. 25, # 7 art. no. 691, p. 995 - 1000
  • Route3
    • null|null
      137066-22-9
    • ~65%
    • In-stock
      4-Iodobenzonitrile|CS-W009114
      3058-39-7

    References

    • Filimonov, Victor D.; Trusova, Marina; Postnikov, Pavel; Krasnokutskaya, Elena A.; Lee, Young Min; Hwang, Ho Yun; Kim, Hyunuk; Chi, Ki-Whan Organic Letters, 2008 , vol. 10, # 18 p. 3961 - 3964

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 3439
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P302+P352-P304+P340

Quality Control

To search for quality control of cas , please enter both the product number and the lot/batch number.

Computational Chemistry Data

  • TPSA   23.79
  • LogP   2.16288
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

Other Classifications

Recently Viewed Products

Leave US a Message
Upload Pictures

Key Words

  • 4-Iodobenzonitrile sigma4-Iodobenzonitrile manufacturer4-Iodobenzonitrile price4-Iodobenzonitrile structure4-Iodobenzonitrile SDSbuy 4-Iodobenzonitrile4-Iodobenzonitrile supplier4-Iodobenzonitrile uses4-Iodobenzonitrile molecular weightprice of 4-Iodobenzonitrile4-Iodobenzonitrile chemical name formula of 4-Iodobenzonitrile
This product is not sold in the region.
Confirm
How to get a Lot Number

Lot numbers can be found on the outside label of a product:

ChemScene Label