116-16-5 | 2-Propanone, 1,1,1,3,3,3-hexachloro-

Packsize	Purity	Availability	Price	Discounted Price
25g	99%	in stock	$17.00	$12.00
100g	99%	in stock	$25.00	$18.00

Description

• Catalog Number: AA22390
• Chemical Name: 2-Propanone, 1,1,1,3,3,3-hexachloro-
• CAS Number: 116-16-5
• Molecular Formula: C3Cl6O
• Molecular Weight: 264.7495
• MDL Number: MFCD00000796
• SMILES: O=C(C(Cl)(Cl)Cl)C(Cl)(Cl)Cl
• NSC Number: 6852

Computed Properties

• Complexity: 124
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 10
• Hydrogen Bond Acceptor Count: 1
• XLogP3: 3.7

Upstream Synthesis Route

Hexachloroacetone is a versatile chemical compound that finds applications across various chemical synthesis processes. In organic chemistry, Hexachloroacetone serves as a valuable building block for the synthesis of a wide range of compounds. Its unique reactivity allows for the formation of complex structures through various reactions such as nucleophilic additions, rearrangements, and substitutions. This compound is particularly useful in the preparation of heterocyclic compounds, pharmaceutical intermediates, and specialty chemicals. Additionally, Hexachloroacetone is also employed in the manufacturing of pesticides, dyes, and polymer additives due to its ability to introduce chlorinated moieties into organic molecules. Its diverse applications highlight its significance in the realm of chemical synthesis, making it a valuable tool for researchers and industrial chemists alike.

Literature

• An efficient approach to chiral C8/C9-piperazino-substituted 1,4-benzodiazepin-2-ones as peptidomimetic scaffolds.

  The Journal of organic chemistry 20081107

• Lanthanum aryloxide/pybox-catalyzed direct asymmetric Mannich-type reactions using a trichloromethyl ketone as a propionate equivalent donor.

  Journal of the American Chemical Society 20070808

• Hexachloroacetone as a precursor for a tetrachloro-substituted oxyallyl intermediate: [4+3] cycloaddition to cyclic 1,3-dienes.

  Molecules (Basel, Switzerland) 20040131