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2-Methyl-3-nonanone, also known as Vauquelinite, is a chemical compound with the formula C10H20O. It is a clear, colorless liquid characterized by a strong, sweet, floral odor. 2-METHYL-3-NONANONE is recognized for its low toxicity and is generally regarded as safe for use in various applications.

5445-31-8

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5445-31-8 Usage

Uses

Used in Flavor and Fragrance Industry:
2-Methyl-3-nonanone is used as a flavor and fragrance ingredient for its distinctive sweet, floral scent, enhancing the sensory experience in food and cosmetics products.
Used in Chemical and Pharmaceutical Production:
2-Methyl-3-nonanone serves as an intermediate in the synthesis of various chemicals and pharmaceuticals, contributing to the development of new compounds and formulations.
Used in Adhesives, Paints, and Coatings Manufacturing:
2-METHYL-3-NONANONE is utilized in the production of adhesives, paints, and coatings to improve product performance and characteristics, such as adhesion, drying time, and durability.

Check Digit Verification of cas no

The CAS Registry Mumber 5445-31-8 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 5,4,4 and 5 respectively; the second part has 2 digits, 3 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 5445-31:
(6*5)+(5*4)+(4*4)+(3*5)+(2*3)+(1*1)=88
88 % 10 = 8
So 5445-31-8 is a valid CAS Registry Number.
InChI:InChI=1/C10H20O/c1-4-5-6-7-8-10(11)9(2)3/h9H,4-8H2,1-3H3

5445-31-8SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-methylnonan-3-one

1.2 Other means of identification

Product number -
Other names 2-methyl-nonan-3-one

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:5445-31-8 SDS

5445-31-8Relevant academic research and scientific papers

α-Methylation of Ketones with Methanol Catalyzed by Ni/SiO2-Al2O3

Charvieux, Aubin,Duguet, Nicolas,Métay, Estelle

supporting information, p. 3694 - 3698 (2019/06/13)

α-Methylation of ketones with methanol catalyzed by a cheap and easy to handle Ni/SiO2-Al2O3 was explored. After optimization of the reaction between propiophenone and methanol, the desired product was obtained in 95 % isolated yield. A wide range of ketones was methylated under the optimized conditions (16 examples). This procedure was extended to a three-component cross-benzylation-methylation of acetophenone.

Conversion of Aldehydes to Branched or Linear Ketones via Regiodivergent Rhodium-Catalyzed Vinyl Bromide Reductive Coupling-Redox Isomerization Mediated by Formate

Swyka, Robert A.,Shuler, William G.,Spinello, Brian J.,Zhang, Wandi,Lan, Chunling,Krische, Michael J.

supporting information, p. 6864 - 6868 (2019/05/10)

A regiodivergent catalytic method for direct conversion of aldehydes to branched or linear alkyl ketones is described. Rhodium complexes modified by PtBu2Me catalyze formate-mediated aldehyde-vinyl bromide reductive coupling-redox isomerization to form branched ketones. Use of the less strongly coordinating ligand, PPh3, promotes vinyl-to allylrhodium isomerization en route to linear ketones. This method bypasses the 3-step sequence often used to convert aldehydes to ketones involving the addition of pre-metalated reagents to Weinreb or morpholine amides.

Ir-catalysed formation of C-F bonds. From allylic alcohols to α-fluoroketones

Ahlsten, Nanna,Martin-Matute, Belen

, p. 8331 - 8333 (2011/09/12)

A novel iridium-catalysed tandem isomerisation/C-F bond formation from allylic alcohols and Selectfluor to prepare α-fluorinated ketones as single constitutional isomers is reported.

A facile synthesis of α-fluoro ketones catalyzed by [Cp*IrCl2]2

Ahlsten, Nanna,Bartoszewicz, Agnieszka,Agrawal, Santosh,Martin-Matute, Belen

supporting information; experimental part, p. 2600 - 2608 (2011/10/02)

Allylic alcohols are isomerized into enolates (enols) by [Cp*IrCl2]2. The enolates react with Selectfluor present in the reaction media. This method produces α-fluoro ketones as single constitutional isomers in high yields. Georg Thieme Verlag Stuttgart. New York.

Reaction of α-Silyl Esters with Grignard Reagents: A Synthesis of β-Keto Silanes and Ketones. Preparation of the Douglas Fir Tussock Moth Pheromone

Larson, Gerald L.,Hernandez, David,Lopez-Cepero, Ingrid Montes de,Torres, Luz E.

, p. 5260 - 5267 (2007/10/02)

A variety of α-diphenylmethylsilyl esters have been prepared and reacted with Grignard reagents.The reaction is relatively slow in refluxing THF and can be controlled to allow the addition of 1 equiv of the Grignard reagent, providing the corresponding β-keto silane.Protiodesilylation of the β-keto silane results in the overall conversion of an ester to a ketone.This ester to ketone methodology has been applied to a two-step synthesis of the pheromone of the Douglas fir tussock moth.The β-keto silanes are viable precursors to regioselectively generated enol silyl ethers.The reaction of ethyl 2-methyl-2-(diphenylmethylsilyl)propionate with vinylmagnesium bromide or 2-methyl 1-propenylmagnesium bromide results in the addition of 2 equiv of the Grignard reagent, the second in a Michael fashion.

Low Temperature Free-Radical Reactions Initiated with tert-Butyl p-Benzoylperbenzoate. Selective Acyl Radical Additions to Substituted Olefins

Gottschalk, Peter,Neckers, D. C.

, p. 3498 - 3502 (2007/10/02)

Competition experiments involving acyl radical additions to simple and electron-deficient olefins showed a definite preference for acylation of the latter olefin.This selectivity was significantly enhanced by using low temperature initiation with tert-butyl p-benzoylperbenzoate (1), which allows selective initiation of free-radical cyclization reactions that have synthetic importance.

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