2516-99-6 | 3,3,3-Trifluoropropionic acid

Packsize	Purity	Availability	Price	Discounted Price
1g	97%	in stock	$10.00	$7.00
5g	97%	in stock	$20.00	$14.00
10g	97%	in stock	$24.00	$17.00
25g	97%	in stock	$45.00	$32.00
100g	97%	in stock	$149.00	$104.00

Description

• Catalog Number: AB27708
• Chemical Name: 3,3,3-Trifluoropropionic acid
• CAS Number: 2516-99-6
• Molecular Formula: C3H3F3O2
• Molecular Weight: 128.0499
• MDL Number: MFCD00153292
• SMILES: OC(=O)CC(F)(F)F

Computed Properties

• Complexity: 95.2
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 8
• Hydrogen Bond Acceptor Count: 5
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1
• XLogP3: 0.8

Upstream Synthesis Route

3,3,3-Trifluoropropanoic acid, also known as trifluoroacetic acid, plays a significant role in chemical synthesis due to its unique properties and versatile applications. As a strong acid and effective solvent, this compound is commonly used in various organic reactions and as a catalyst in polymerization processes. Its trifluoromethyl group makes it a valuable building block in the synthesis of pharmaceuticals, agrochemicals, and materials science. Additionally, 3,3,3-Trifluoropropanoic acid can act as a key intermediate in the production of fluorinated compounds, enabling the incorporation of fluorine atoms into organic molecules for improved stability and bioactivity. Its utility in promoting selective and efficient transformations underscores its importance in modern synthetic chemistry.

Literature

• Biotransformation of trans-1,1,1,3-tetrafluoropropene (HFO-1234ze).

  Toxicology and applied pharmacology 20090915

• On the computation and contribution of conductivity in molecular ionic liquids.

  The Journal of chemical physics 20080407

• A [2 + 2] cycloaddition route to dimethylaminomethylene vinamidinium salts.

  Organic letters 20020822

• Biotransformation of 1,1,1,3,3-Pentafluoropropane (HFC-245fa).

  Chemical research in toxicology 20020501