Tel:

Email:

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

2-Bromo-5-(tert-butyl)-1,3-dimethylbenzene

  • CAS No. 5345-05-1

  • Cat. No. CS-0162473
  • Purity≥98%
  • MDL No.None

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

2-Bromo-5-(tert-butyl)-1,3-dimethylbenzene|CS-0162473

Structure of 5345-05-1

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

* Please select Quantity before adding items.

General Information

  • CAS No. 5345-05-1
  • Cat. No. CS-0162473
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₇Br
  • Molecular Weight 241.17
  • Synonym(s) 2-Bromo-5-tert-butyl-1,3-dimethylbenzene
  • SMILES CC1=C(Br)C(C)=CC(C(C)(C)C)=C1

Description

Tolmetin Sodium is an anti-inflammatory, antirheumatic agent. It can inhibit aldo-keto reductases (e.g., IC50 = 2.39 μM for human aldose reductase), a family of enzymes that catalyze the NADPH-dependent reduction of carbonyl groups in a number of important steroid, metabolic, and prostanoid molecules. It is a beta-adrenergic blocker.

Application

2-Bromo-5-(tert-butyl)-1,3-dimethylbenzene serves as a versatile building block in medicinal chemistry and materials synthesis, enabling palladium-catalyzed cross-coupling reactions. The tert-butyl group provides steric shielding and enhances bench stability, while the bromine atom facilitates reliable C–C bond formation under standard Suzuki, Stille, or Negishi conditions. Its ortho-substituted aryl scaffold offers predictable reactivity and ease of purification, making it ideal for constructing complex aromatic architectures in high-throughput workflows.

Synthesis

  • Route1

    References

    • Field, Jason E.; Hill, Thomas J.; Venkataraman Journal of Organic Chemistry, 2003 , vol. 68, # 16 p. 6071 - 6078
  • Route2

    References

    • Chevron Research Company Patent: US4340757 A1, 1982 ;
  • Route3
    • null|null
      108-38-3
    • ~%
    • In-stock
      2-Bromo-5-(tert-butyl)-1,3-dimethylbenzene|CS-0162473
      5345-05-1

    References

    • Buu-Hoi; Cagniant Bulletin de la Societe Chimique de France, 1942 , vol. <5> 9, p. 889,892

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319
Precautionary Statements : P264-P280-P302+P352-P362+P364

Quality Control

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

Computational Chemistry Data

  • TPSA   0
  • LogP   4.36344
  • H_Acceptors   0
  • H_Donors   0
  • Rotatable_Bonds   0

Recently Viewed Products

Leave US a Message
Upload Pictures

Key Words

  • 5345-05-1 sigma5345-05-1 manufacturer5345-05-1 price5345-05-1 structure5345-05-1 SDSbuy 5345-05-15345-05-1 supplier5345-05-1 uses5345-05-1 molecular weightprice of 5345-05-15345-05-1 chemical name formula of 5345-05-1
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