Musk Ketone

Musk Ketone

Superior Fixative Properties: Ketone musk is a recognized excellent fixative in fragrance formulations. Only a small amount is needed to effectively stabilize the evaporation rate of fragrances, prolong the scent's longevity, and make the release of the aroma smoother and more persistent.


Elegant Musk Aroma: Ketone musk possesses an elegant and rich musky aroma, with a slight natural musky note and a powdery finish. The aroma is soft, long-lasting, and more elegant than xylene musk.


Good Compatibility and Blending Properties: Ketone musk exhibits good compatibility with various fragrance components and can be used in combination with methyl ionone, cinnamyl alcohol, benzyl salicylate, and other fragrance ingredients. Its sweet, slightly floral-musky aroma can soften and round out the sharp notes of various fragrances.


Mature Synthetic Process: Ketone musk is synthesized from m-xylene through a three-step reaction involving tert-butylation, acetylation, and nitration. The process route is mature. Employing a continuous production process, the reaction conversion rate can reach 93.79%, and the yield can reach 88.1%, making it suitable for large-scale industrial production.


Multi-field application value: Ketone musk is not only widely used in the formulation and fixation of fragrances in cosmetics, soaps, detergents, and other daily chemical products, but it can also be used as a masking agent in cosmetics to cover unpleasant odors, and as a flavoring agent or auxiliary agent in food additives.


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Product Description

Musk Ketone Product Description CAS#81-14-1


Musk ketone is a nitro-based synthetic musk, chemically named 1-(4-tert-butyl-2,6-dimethyl-3,5-dinitrophenyl)ethyl ketone, with the molecular formula C₁₄H₁₈N₂O₅ and a molecular weight of 294.31. At room temperature, it is a white to pale yellow flaky crystal or crystalline powder. Its melting point is 134–137°C, boiling point is approximately 369°C (760 mmHg), and flash point is >93°C (closed cup). Musk ketone is insoluble in water, slightly soluble in ethanol, and soluble in benzyl benzoate, animal oils, and essential oils. Industrially, ketone is produced from m-xylene through a three-step reaction involving tert-butylation, acetylation, and nitration. The nitration reaction is carried out in a tubular reactor using a mixture of fuming nitric acid and concentrated sulfuric acid, with the reaction temperature controlled between -10°C and -5°C. A continuous production process using trichloroethane as the solvent is employed, achieving a conversion rate of 93.79%. Ketone musk possesses an elegant and rich musky aroma, with a subtle natural musky note and a powdery finish. The aroma is mellow and long-lasting. Its fragrance quality is more elegant than that of xylene musk. In its diluted state, it exhibits fruity-floral notes. Ketone musk is chemically stable but incompatible with strong oxidizing agents, strong acids, and strong bases.


Ketone Musk Product Applications CAS#81-14-1


Ketone musk is an important synthetic fragrance compound widely used in the daily chemical fragrance industry. In fragrance formulations, ketone musk is mainly used as a fixative, stabilizing the evaporation rate of the fragrance and improving its persistence. The dosage is usually below 10%. Ketone musk is widely used in the formulation of cosmetic and soap fragrances, and is an indispensable fixative in these fragrance formulations. Its aroma can soften and round out the sharp notes of floral, woody, amber, and resinous scents, making the overall fragrance harmonious and unified. Ketone musk can be compounded with fragrances such as methyl ionone, cinnamyl alcohol, and benzyl salicylate to formulate powdered fragrances. In cosmetics, ketone musk can also be used as a masking agent to cover up unpleasant odors from other ingredients in the formulation. As an edible flavoring agent, ketone musk can be used as a flavoring agent or auxiliary agent in food additives. It is important to note that due to the bioaccumulation risks and environmental persistence issues of nitromuses, the European Union listed ketone musk as a prohibited substance in cosmetics in 2009, and Japan has also completely banned nitromuses. China's "Cosmetic Hygiene Standards" implements quantity limits for ketone musk.


Product Information

Chemical Properties
PropertyValue

Melting point

134-137 °C

Boiling point

436.08°C (rough estimate)

Density

1.2051 (rough estimate)

Vapor pressure

0.001Pa at 25℃

Refractive index

1.5110 (estimate)

Fp

2 °C

Storage temp.

2-8°C

Solubility

DMSO : 250 mg/mL (849.47 mM; Need ultrasonic)

Form

Solid

Color

White to off-white

Odor

At 10.00 % in benzyl benzoate. fatty musk soapy dry floral powdery

Odor Type

musk

Biological source

Synthetic

Water Solubility

Insoluble (<0.1 g/100 mL at 20 ºC)

BRN

2062638

Stability

Stable. Incompatible with strong oxidizing agents, strong acids, strong bases.

InChIKey

WXCMHFPAUCOJIG-UHFFFAOYSA-N

LogP

4.24 at 25℃

CAS DataBase Reference

81-14-1(CAS DataBase Reference)

NIST Chemistry Reference

2,6-Dimethyl-3,5-dinitro-4-t-butylacetophenone(81-14-1)

EPA Substance Registry System

Musk ketone (81-14-1)

Safety Information

PropertyValue
Hazard symbolsF, Xn, N
Hazard class codes11-20/21/22-36-50/53-40
Safety descriptions16-36/37-61-60-46
UN dangerous goods numberUN 1648 3/PG 2
WGK Germany2
RTECS numberKM5775841
TSCATSCA listed
HS code2914790060
Storage class3 - Flammable liquids
Hazard class (category)Acute toxicity, Category 4, Dermal
Acute toxicity, Category 4, Inhalation
Acute toxicity, Category 4, Oral
Eye irritation, Category 2
Flammable liquid, Category 2
Hazardous substances data81-14-1 (Hazardous Substances Data)
ToxicityBoth the acute oral LD₅₀ in rats and the acute dermal LD₅₀ in rabbits exceeded 10 g/kg (Fogleman, 1970).


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