4,4,4-Trifluoro-1-(4-methoxyphenyl)butane-1,3-dione

Name: 4,4,4-Trifluoro-1-(4-methoxyphenyl)butane-1,3-dione
Brand: ChemScene
Availability: InStock
Rating: 5 (1 reviews)

CAS No. 15191-68-1
Cat. No. CS-0063893
Purity≥97%
MDL No.None

HazMat Fee +

HazMat Fee

An item is classified as a dangerous good if our website displays Hazardous Material (HazMat) information for it. There is a HazMat shipping fee for each item that qualifies as a dangerous good, except in the following scenarios:

The shipment is processed through FedEx Ground under the Limited Quantity option.

Each bottle is packed as an Excepted Quantity, with a maximum of 1g for items in class 6.1 packing group I or II, and up to 25g for all other hazardous materials.

If shipping is charged to your FedEx account, the HazMat fee will be billed directly by the courier. Otherwise, the fee will be included on your invoice. To help you avoid the HazMat fee, we can package a 5g order of a class 6.1 packing group I or II material as five separate 1g units, and a 100g order of any other dangerous good as four 25g units. This packaging adjustment will be made unless you instruct otherwise on your purchase order. Below, you will find the fee schedule from FedEx for handling hazardous materials.

Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

An item is classified as a dangerous good if our website displays Hazardous Material (HazMat) information for it.

There is a HazMat shipping fee for each item that qualifies as a dangerous good. Please contact our quotation team via email to confirm the details.

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

4,4,4-Trifluoro-1-(4-methoxyphenyl)butane-1,3-dione|CS-0063893

Structure of 15191-68-1

Size

Price

Quantity

* Please select Quantity before adding items.

General Information

CAS No. 15191-68-1
Cat. No. CS-0063893
Purity ≥97%
MDL No. None
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₁H₉F₃O₃
Molecular Weight 246.18
Synonym(s) 2,4-Butanedione, 1,1,1-trifluoro-4-(4-methoxyphenyl)-
SMILES O=C(C1=CC=C(OC)C=C1)CC(C(F)(F)F)=O

Description

This trifluoromethylated diketone features a para-methoxyphenyl substituent that enhances solubility and electronic modulation. The electron-deficient β-dicarbonyl system enables facile enolization and participation in C–C bond-forming reactions under mild conditions. Bench-stable and moisture-tolerant, it serves as a key building block for fluorinated heterocycles and bioactive molecule synthesis.

Application

4,4,4-Trifluoro-1-(4-methoxyphenyl)butane-1,3-dione serves as a versatile β-diketone building block for heterocyclic synthesis, enabling efficient access to fluorinated pyrazoles and other nitrogen-containing scaffolds via condensation reactions. Its trifluoromethylated alkyl chain enhances metabolic stability and lipophilicity, while the methoxy-substituted aryl group provides favorable electronic tuning and solubility. The compound exhibits good bench stability and facilitates straightforward purification, making it well-suited for medicinal chemistry and process development workflows.

Synthesis

Route1
- 383-63-1
- In-stock
  
  100-06-1
- ~90%
- In-stock
  
  15191-68-1
References
- Singh, Sunil K.; Saibaba; Rao, K. Srinivasa; Reddy, P. Ganapati; Daga, Pankaj R.; Rajjak, S. Abdul; Misra, Parimal; Rao, Y. Koteswar European Journal of Medicinal Chemistry, 2005 , vol. 40, # 10 p. 977 - 990
Route2
- In-stock
  
  100-06-1
- ~56%
- In-stock
  
  15191-68-1
References
- J.B. Chemicals and Pharmaceuticals Limited Patent: US2001/47023 A1, 2001 ;

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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

Computational Chemistry Data

TPSA 43.37
LogP 2.3994
H_Acceptors 3
H_Donors 0
Rotatable_Bonds 4

Other Classifications

Building Blocks Functional Group Ketone

Catalysts and Ligands Ligands Other Oxygen Ligands Diketone Series Ligands

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Catalysis Diketone Ligands

Key Words

15191-68-1 sigma15191-68-1 manufacturer15191-68-1 price15191-68-1 structure15191-68-1 SDSbuy 15191-68-115191-68-1 supplier15191-68-1 uses15191-68-1 molecular weightprice of 15191-68-115191-68-1 chemical name formula of 15191-68-1

Salutation:	*Country or Region:
*Applicant Name:	*Organization Name:
*Email Address:	Quantity:
CAS NO. :	Product Name:
Remarks:
Upload Pictures

CAS.No.		Product Name
Applicant Name *		Email Address *
Phone Number *		Organization Name*
Country or Region*		Quantity*
Remarks:

Product Name:
Cat. No.: .		CAS NO. :
Quantity:

4,4,4-Trifluoro-1-(4-methoxyphenyl)butane-1,3-dione

CAS No. 15191-68-1

Recommended Products