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2,4,4-TRIMETHYL-2-CYCLOHEXEN-1-ONE is a chemical with a specific purpose. Lookchem provides you with multiple data and supplier information of this chemical.

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  • 13395-71-6 Structure
  • Basic information

    1. Product Name: 2,4,4-TRIMETHYL-2-CYCLOHEXEN-1-ONE
    2. Synonyms: 2,4,4-TRIMETHYL-2-CYCLOHEXEN-1-ONE;2 4 4-TRIMETHYL-2-CYCLOHEXEN-1-ONE 98%;2,4,4-TRIMETHYLCYCLOHEX-2-ENONE
    3. CAS NO:13395-71-6
    4. Molecular Formula: C9H14O
    5. Molecular Weight: 138.21
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 13395-71-6.mol
  • Chemical Properties

    1. Melting Point: 158 °C
    2. Boiling Point: 81-82 °C20 mm Hg(lit.)
    3. Flash Point: 151 °F
    4. Appearance: /
    5. Density: 0.924 g/mL at 25 °C(lit.)
    6. Refractive Index: n20/D 1.476(lit.)
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: 2,4,4-TRIMETHYL-2-CYCLOHEXEN-1-ONE(CAS DataBase Reference)
    10. NIST Chemistry Reference: 2,4,4-TRIMETHYL-2-CYCLOHEXEN-1-ONE(13395-71-6)
    11. EPA Substance Registry System: 2,4,4-TRIMETHYL-2-CYCLOHEXEN-1-ONE(13395-71-6)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany: 3
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 13395-71-6(Hazardous Substances Data)

13395-71-6 Usage

Physical state

Colorless liquid

Aroma

Strong, floral

Usage

Flavoring agent in food products, fragrance ingredient in perfumes and personal care products, synthesis of other chemicals

Safety

Generally considered safe for use in consumer products when used in specified concentrations, but should be handled and used according to recommended safety guidelines to minimize potential risks.

Check Digit Verification of cas no

The CAS Registry Mumber 13395-71-6 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 1,3,3,9 and 5 respectively; the second part has 2 digits, 7 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 13395-71:
(7*1)+(6*3)+(5*3)+(4*9)+(3*5)+(2*7)+(1*1)=106
106 % 10 = 6
So 13395-71-6 is a valid CAS Registry Number.

13395-71-6SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 16, 2017

Revision Date: Aug 16, 2017

1.Identification

1.1 GHS Product identifier

Product name 2,4,4-trimethylcyclohex-2-en-1-one

1.2 Other means of identification

Product number -
Other names 2,4,4-trimethyl-2-cyclohexenone

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:13395-71-6 SDS

13395-71-6Relevant articles and documents

Protecting-Group-Free Syntheses of ent-Kaurane Diterpenoids: [3+2+1] Cycloaddition/Cycloalkenylation Approach

Hong, Benke,Hu, Dachao,Kadonaga, Yuichiro,Lei, Xiaoguang,Tang, Ruyao,Wang, Jin

, p. 2238 - 2243 (2020)

The Yu's Rh-catalyzed [3+2+1] cycloaddition followed by a Pd-mediated 5-endo cycloalkenylation is shown to be a general and powerful approach for efficient construction of the tetracyclic core structure of ent-kaurane diterpenoids. The utility of this strategy was further demonstrated by concise and protecting-group-free total syntheses of ent-1α-hydroxykauran-12-one, 12-oxo-9,11-dehydrokaurene, and 12α-hydroxy-9,11-dehydrokaurene.

Highly Active Cooperative Lewis Acid—Ammonium Salt Catalyst for the Enantioselective Hydroboration of Ketones

Titze, Marvin,Heitk?mper, Juliane,Junge, Thorsten,K?stner, Johannes,Peters, René

supporting information, p. 5544 - 5553 (2021/02/05)

Enantiopure secondary alcohols are fundamental high-value synthetic building blocks. One of the most attractive ways to get access to this compound class is the catalytic hydroboration. We describe a new concept for this reaction type that allowed for exceptional catalytic turnover numbers (up to 15 400), which were increased by around 1.5–3 orders of magnitude compared to the most active catalysts previously reported. In our concept an aprotic ammonium halide moiety cooperates with an oxophilic Lewis acid within the same catalyst molecule. Control experiments reveal that both catalytic centers are essential for the observed activity. Kinetic, spectroscopic and computational studies show that the hydride transfer is rate limiting and proceeds via a concerted mechanism, in which hydride at Boron is continuously displaced by iodide, reminiscent to an SN2 reaction. The catalyst, which is accessible in high yields in few steps, was found to be stable during catalysis, readily recyclable and could be reused 10 times still efficiently working.

Method for producing cyclolavandulol and derivative thereof

-

Paragraph 0077; 0078; 0079; 0080; 0081; 0082; 0083-0088, (2016/11/24)

The present invention easily, efficiently, and selectively produces a prescribed compound. More specifically, the present invention provides a method for producing (2,4,4-trimethyl-2-cyclohexene)methanol, said method at least comprising: a step for obtain

METHOD FOR PRODUCING CYCLOLAVANDULOL AND DERIVATIVE THEREOF

-

Paragraph 0066-0073, (2016/08/29)

A targeted compound is produced simply, efficiently and selectively. Specifically provided are a method for producing (2,4,4-trimethyl-2-cyclohexene)methanol, comprising the steps of: reacting the carbonyl group of 2,4,4-trimethyl-2-cyclohexenone (1) to o

METHODS FOR PRODUCING BETA-CYCLOLAVANDULAL AND DERIVATIVE OF SAME

-

Paragraph 0083; 0084; 0085; 0086; 0087; 0088; 0089-0091, (2016/08/29)

Target compounds are synthesized simply, efficiently and selectively. More specifically, provided are a method for producing (2,4,4-trimethyl-1-cyclohexene)carbaldehyde, comprising the steps of: reacting the carbonyl group of 2,4,4-trimethyl-2-cyclohexeno

Method for producing [beta]-cyclolavandulal and derivative of same

-

Paragraph 0095; 0096; 0097; 0098; 0099; 0100-0106, (2016/12/22)

A given compound is synthesized simply, efficiently, and selectively. Specifically, provided are a method for producing (2,4,4-trimethyl-1-cyclohexene)carbaldehyde including at least a step for obtaining a 2,4,4-trimethyl-2-cyclohexenylidene methyl ether compound (2) by reacting the carbonyl groups of 2,4,4-trimethyl-2-cyclohexenone (1) and a step for obtaining (2,4,4-trimethyl-1-cyclohexene)carbaldehyde (3) by hydrolyzing (2), a method for producing (2,4,4-trimethyl-1-cyclohexene)methanol including at least a step for obtaining (2,4,4-trimethyl-1-cyclohexene)methanol (4) by reducing (3), and a method for producing a (2,4,4-trimethyl-1-cyclohexenyl)methyl ester compound including at least a step for obtaining a (2,4,4-trimethyl-1-cyclohexenyl)methyl ester compound (5) by esterifying (4).

Synthesis, chemical reactivity as michael acceptors, and biological potency of monocyclic cyanoenones, novel and highly potent anti-inflammatory and cytoprotective agents(1)

Zheng, Suqing,Santosh Laxmi,David, Emilie,Dinkova-Kostova, Albena T.,Shiavoni, Katherine H.,Ren, Yanqing,Zheng, Ying,Trevino, Isaac,Bumeister, Ronald,Ojima, Iwao,Wigley, W. Christian,Bliska, James B.,Mierke, Dale F.,Honda, Tadashi

supporting information; body text, p. 4837 - 4846 (2012/07/03)

Novel monocyclic cyanoenones examined to date display unique features regarding chemical reactivity as Michael acceptors and biological potency. Remarkably, in some biological assays, the simple structure is more potent than pentacyclic triterpenoids (e.g

Enantioselective microbial oxidation of allyl alcohols

Matsumoto, Kazutsugu,Kawabata, Yoichi,Okada, Satoshi,Takahashi, Jun,Hashimoto, Key,Nagai, Yuto,Tatsuta, Junichi,Hatanaka, Minoru

, p. 1428 - 1429 (2008/03/18)

A new route to the optically active allyl alcohols by microbial oxidation is disclosed. Yamadazyma farinosa IFO 10896, a yeast, efficiently catalyzes the enantioselective oxidation of allyl alcohols to afford the corresponding optically active alcohols as the remaining substrates. This reaction is applicable to both cyclic and acyclic compounds. Copyright

Process for the preparation of cyclic ketones

-

, (2008/06/13)

The invention provides a process for the preparation of cyclic ketones of the general formula STR1 in which R represents an optionally substituted alkyl or cycloalkyl group and R 1 and R 2 independently represent an optionally substituted alkyl, cycloalkyl or aryl group, which comprises heating a compound of the general formula STR2 in which X represents a chlorine or bromine atom and R is as defined above, with a compound of the general formula STR3 in which R 1 and R 2 are as defined above, in the presence of an organic acid.Certain cyclic ketones of formula (I) are useful as intermediates in the preparation of certain fungicidally active cyclopentane derivatives.

LIMITATIONS IN THE APPLICATION OF ANIONIC OXY-COPE SIGMATROPY TO ELABORATION OF THE FORSKOLIN NUCLEUS

Paquette, Leo A.,Oplinger, Jeffrey A.

, p. 107 - 124 (2007/10/02)

The functionalized bicyclooctenone 6 has been synthesized in four steps from 2,4,4-trimethyl-2-cyclohexenone.This ketone undergoes 1,2-addition with 6-lithiodihydropyran to deliver alcohols 16 and 17 in a 1:1.8 ratio.The potassium salt of 17 experi

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