CAS 401-84-3

1,3-Dibromo-5-(trifluoromethyl)benzene

Description:

1,3-Dibromo-5-(trifluoromethyl)benzene is an aromatic compound characterized by the presence of two bromine atoms and a trifluoromethyl group attached to a benzene ring. The molecular structure features bromine substituents at the 1 and 3 positions, while the trifluoromethyl group is located at the 5 position, contributing to its unique chemical properties. This compound is typically a colorless to pale yellow solid at room temperature and is known for its relatively high stability due to the aromatic nature of the benzene ring. The presence of bromine and trifluoromethyl groups enhances its reactivity, making it useful in various chemical syntheses and applications, including as an intermediate in the production of pharmaceuticals and agrochemicals. Additionally, the trifluoromethyl group imparts significant lipophilicity, influencing the compound's solubility and interaction with biological systems. Safety precautions should be taken when handling this substance, as it may pose health risks and environmental hazards.

Formula: C₇H₃Br₂F₃

InChI: InChI=1S/C7H3Br2F3/c8-5-1-4(7(10,11)12)2-6(9)3-5/h1-3H

InChI key: InChIKey=OFNXSUANJLHGQN-UHFFFAOYSA-N

SMILES: C(F)(F)(F)C1=CC(Br)=CC(Br)=C1

Synonyms:

• 3,5-Dibromo-1-(trifluoromethyl)benzene
• 3,5-Dibromobenzotrifluoride
• Benzene, 1,3-dibromo-5-(trifluoromethyl)-
• Fxffr Ce Ee
• Toluene, 3,5-dibromo-α,α,α-trifluoro-
• 1,3-Dibromo-5-(trifluoromethyl)benzene

3,5-Dibromobenzotrifluoride

CAS: 401-84-3

Formula: C₇H₃Br₂F₃

Purity: >98.0%(GC)

Color and Shape: Colorless to Light yellow to Light orange clear liquid

Molecular weight: 303.90

Ref: 3B-D4807

3,5-Dibromobenzotrifluoride

CAS: 401-84-3

Formula: C₇H₃Br₂F₃

Purity: 97%

Color and Shape: Liquid

Molecular weight: 303.9019

Ref: IN-DA00C0F1

3,5-Dibromobenzotrifluoride

CAS: 401-84-3

3,5-Dibromobenzotrifluoride

Formula: C₇H₃Br₂F₃

Purity: 96%

Color and Shape: Pale Yellow Solid

Molecular weight: 303.90192g/mol

Ref: 54-PC51005

3,5-Dibromobenzotrifluoride

CAS: 401-84-3

Formula: C₇H₃Br₂F₃

Purity: 97%

Color and Shape: Clear

Molecular weight: 303.904

Ref: 10-F034770

1,3-dibromo-5-(trifluoromethyl)benzene

CAS: 401-84-3

1,3-Dibromo-5-(trifluoromethyl)benzene (DBTB) is a chemical compound that belongs to the class of frameworks. It is an inhibitor of bacterial hydrolases and has shown to have an effect against the growth of gram-negative pathogens such as Pneumoniae, Klebsiella pneumoniae, and K. pneumoniae. The synthesis of DBTB involves a nucleophilic attack on 1,3-dibromobenzene by a phosphorylated pyrophosphate. This enzyme inhibitor is synthesized in two steps: first, the formation of a halide salt with piperazine followed by its reaction with hydrogen peroxide. The active site for this molecule was determined using X-ray diffraction analysis and ligand binding studies show that it binds to the active site at the catalytic site of the enzyme.

Formula: C₇H₃Br₂F₃

Purity: Min. 95%

Molecular weight: 303.9 g/mol

Ref: 3D-FD106192