CAS 94-66-6

2-Allylcyclohexanone

Description:

2-Allylcyclohexanone is an organic compound characterized by its cyclic structure and the presence of both a ketone functional group and an allyl substituent. It features a cyclohexane ring with a ketone group (C=O) at the second position and an allyl group (–CH2–CH=CH2) attached to the same carbon. This compound is typically a colorless to pale yellow liquid with a distinctive odor, often described as sweet and floral. It is soluble in organic solvents but has limited solubility in water due to its hydrophobic cyclohexane structure. 2-Allylcyclohexanone is used in various applications, including as a flavoring agent and in the synthesis of other organic compounds. Its reactivity is influenced by the presence of the double bond in the allyl group, making it susceptible to various chemical reactions such as polymerization and addition reactions. Safety precautions should be observed when handling this compound, as it may pose health risks if inhaled or ingested.

Formula: C₉H₁₄O

InChI: InChI=1S/C9H14O/c1-2-5-8-6-3-4-7-9(8)10/h2,8H,1,3-7H2

InChI key: InChIKey=UPGHEUSRLZSXAE-UHFFFAOYSA-N

SMILES: C(C=C)C1C(=O)CCCC1

Synonyms:

• (2R)-2-prop-2-en-1-ylcyclohexanone
• (2S)-2-prop-2-en-1-ylcyclohexanone
• 2-(2-Propen-1-yl)cyclohexanone
• 2-(2-Propenyl)cyclohexanone
• 2-(Prop-2-En-1-Yl)Cyclohexanone
• 2-(Prop-2-en-1-yl)cyclohexan-1-one
• 2-Allylcyclohexanone
• Ai3-07009
• Cyclohexanone, 2-(2-propen-1-yl)-
• Cyclohexanone, 2-(2-propenyl)-
• Cyclohexanone, 2-allyl-
• Cyclohexanone, 2-allyl- (8CI)
• Nsc 128921

2-Allylcyclohexanone

CAS: 94-66-6

Formula: C₉H₁₄O

Purity: >97.0%(GC)

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

Molecular weight: 138.21

Ref: 3B-A2230

2-Allylcyclohexanone

CAS: 94-66-6

Formula: C₉H₁₄O

Purity: 97%

Color and Shape: Liquid

Molecular weight: 138.2069

Ref: IN-DA003GBW

2-Allylcyclohexanone

CAS: 94-66-6

2-Allylcyclohexanone

Purity: 97%

Molecular weight: 138.21g/mol

Ref: 54-OR963660

2-Allylcyclohexanone

CAS: 94-66-6

Ref: 7W-GK9922

2-Allylcyclohexanone

CAS: 94-66-6

Formula: C₉H₁₄O

Purity: 95.0%

Color and Shape: Liquid

Molecular weight: 138.21

Ref: 10-F047760

2-Allylcyclohexanone

CAS: 94-66-6

2-Allylcyclohexanone is an unsaturated ketone that is synthesized by the ring-opening of allyl cyclohexane carboxylate with sodium hydroxide. It can be used as a chemical intermediate for the synthesis of other compounds. 2-Allylcyclohexanone can also be used to react with hydroxide solution to produce a salt and an alcohol. The hydroxide solution can act as a base, reducing the carbonyl group in the presence of an acid to form the corresponding alcohol. This reaction is stereoselective because it only occurs when there are two different groups on adjacent carbons.
2-Allylcyclohexanone has been shown to inhibit non-nucleoside reverse transcriptase inhibitors (NNRTIs) such as nevirapine, efavirenz, and delavirdine. In addition, it has been found to have functional groups that are capable of reacting

Formula: C₉H₁₄O

Purity: Min. 95%

Molecular weight: 138.21 g/mol

Ref: 3D-AAA09466