104355-62-6

Usage

Explanation

The molecular formula represents the number of atoms of each element present in a molecule of the compound.

Explanation

A cyclic diketone is a type of organic compound that contains a ring structure with two carbonyl groups (C=O) attached to it.

Explanation

The cyclohexane ring is a six-membered carbon ring, and the two carbonyl groups are connected to the ring, forming the cyclic diketone structure.

Explanation

This is another name for the compound, which provides an alternative way to describe its structure.

Explanation

The compound is used as a starting material or intermediate in the production of various organic compounds and is also utilized as a reagent to facilitate specific chemical reactions.

Explanation

The compound's appearance ranges from colorless to a pale yellow hue when in liquid form.

Explanation

The compound has a noticeable and intense smell that can be easily detected.

Explanation

The compound is considered to have a low level of toxicity, which means it can cause harm to living organisms if ingested or exposed to in large quantities.

Explanation

The compound is prone to catching fire easily, making it a potential hazard when not handled properly.

Explanation

Due to its flammable and mildly toxic nature, it is essential to take appropriate safety measures when working with 1,3-Cyclohexanedione, 4,6,6-trimethyl-, such as using gloves, goggles, and a well-ventilated area.

Type of compound

Cyclic diketone

Structure

Two carbonyl groups attached to a cyclohexane ring

Usage

Synthesis of other organic compounds and as a reagent in organic chemistry reactions

Physical appearance

Colorless to pale yellow liquid

Odor

Strong, pungent

Toxicity

Mildly toxic

Flammability

Highly flammable

Safety precautions

Handle with caution

Upstream product

• 99062-03-0 2,2,4-trimethyl-glutaric acid-5-chloride-1-methyl ester 
• 506-82-1 dimethylcadmium 
• 71-43-2 benzene 
• 24047-81-2 2,4,4-Trimethyl-5-keto-hexansaeureethylester 
• 64-17-5 ethanol 
• 641-11-2 (-)-angustione 
• 563-80-4 3-methyl-butan-2-one 
• 585-07-9 tert-Butyl methacrylate 
• 24047-80-1 2,4-dimethyl-4-(2-methyl-[1,3]dioxolan-2-yl)-pentanoic acid ethyl ester 
• 10035-10-6 hydrogen bromide 
• 82262-31-5 4,6-dimethyl-1,3-cyclohexanedione 
• 74-88-4 methyl iodide 

Downstream Products

• 641-11-2 (+/-)-angustione 
• 124611-56-9 4,6,6-trimethyl-cyclohex-4-ene-1,3-dione 

Relevant academic research and scientific papers

SEQUENCE OF ALKYLATION OF CYCLOHEXANE-1,3-DIONE. ALTERNATIVE SYNTHESIS OF (+/-)-ANGUSTIONE

A method is proposed for introducing one, two, or three alkyl substituents into positions 4 and 6 of the cyclohexane-1,3-dione molecule by successive alkylation under the action of strong bases. (+/-)-Angustione (a natural β-diketone) has been synthesized.

Revisiting [3 + 3] route to 1,3-cyclohexanedione frameworks: Hidden aspect of thermodynamically controlled enolates

We have revisited the traditional consecutive Michael-Claisen [3 + 3] process (MC-[3+3]) promising the synthesis of a cyclohexane-1,3-dione derivatives from nonactivated simple ketones and enoates and evaluated its potential in modern organic synthesis. Twenty to thirty examples were demonstrated to be effective. The reactions exhibited remarkable regioselectivity with the Michael addition proceeding through nucleophilic attack by the more hindered site of the ketones without exception. The subsequent Claisen condensation resulted in the formation of carbon-carbon bonds between less hindered site of the ketones and acyl carbon of the enoates. The MC-[3+3] process described is useful for the synthesis of Taxol A-ring synthons in multigram quantities and for the synthesis of other six-membered carbocyclic compounds. A number of control experiments have been conducted to provide strong support for the mechanism of this MC-[3+3].