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Acetic acid 2-methylcyclohexyl ester, also known as 2-Methylcyclohexyl acetate, is a colorless, clear liquid chemical compound with a sweet, fruity odor. It is commonly used as a flavoring agent and fragrance in various consumer products due to its pleasant scent and relatively low toxicity levels.

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  • 50539-19-0 Structure
  • Basic information

    1. Product Name: ACETIC ACID 2-METHYLCYCLOHEXYL ESTER
    2. Synonyms: Aceticacidmethylcyclohexylester
    3. CAS NO:50539-19-0
    4. Molecular Formula: C9H16O2
    5. Molecular Weight: 156.22214
    6. EINECS: 227-231-1
    7. Product Categories: N/A
    8. Mol File: 50539-19-0.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 182 °C
    3. Flash Point: 66.3 °C
    4. Appearance: /
    5. Density: 0.95
    6. Vapor Pressure: 0.508mmHg at 25°C
    7. Refractive Index: 1.444
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: ACETIC ACID 2-METHYLCYCLOHEXYL ESTER(CAS DataBase Reference)
    11. NIST Chemistry Reference: ACETIC ACID 2-METHYLCYCLOHEXYL ESTER(50539-19-0)
    12. EPA Substance Registry System: ACETIC ACID 2-METHYLCYCLOHEXYL ESTER(50539-19-0)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 50539-19-0(Hazardous Substances Data)

50539-19-0 Usage

Uses

Used in Flavoring and Fragrance Industry:
Acetic acid 2-methylcyclohexyl ester is used as a flavoring agent and fragrance for its sweet, fruity odor, enhancing the sensory experience of various consumer products.
Used in Solvent Applications:
In the production of lacquers, paints, and coatings, Acetic acid 2-methylcyclohexyl ester is used as a solvent, aiding in the application and drying process of these products.
Used in Perfume and Personal Care Products:
Acetic acid 2-methylcyclohexyl ester is used as a key ingredient in the manufacturing of perfumes, soaps, and other personal care products, contributing to their pleasant scent and overall appeal.
Used in Environmentally Friendly Applications:
Due to its low toxicity levels and minimal environmental impact when properly handled and disposed of, Acetic acid 2-methylcyclohexyl ester is considered a relatively safe chemical for use in various applications, promoting eco-friendly product development.

Check Digit Verification of cas no

The CAS Registry Mumber 50539-19-0 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 5,0,5,3 and 9 respectively; the second part has 2 digits, 1 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 50539-19:
(7*5)+(6*0)+(5*5)+(4*3)+(3*9)+(2*1)+(1*9)=110
110 % 10 = 0
So 50539-19-0 is a valid CAS Registry Number.
InChI:InChI=1/C9H16O2/c1-7-5-3-4-6-9(7)11-8(2)10/h7,9H,3-6H2,1-2H3

50539-19-0SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 11, 2017

Revision Date: Aug 11, 2017

1.Identification

1.1 GHS Product identifier

Product name ACETIC ACID 2-METHYLCYCLOHEXYL ESTER

1.2 Other means of identification

Product number -
Other names -

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:50539-19-0 SDS

50539-19-0Relevant articles and documents

Anti-Markovnikov Addition of Nucleophiles to a Non-conjugated Olefin via Single Electron Transfer Photochemistry

Gassman, Paul G.,Bottorff, Kyle J.

, p. 5449 - 5452 (2007/10/02)

Nucleophilic solvent has been added regiospecifically in an anti-Markovnikov manner to a simple non-conjugated olefin, 1-methylcyclohexene, through single electron transfer induced photochemistry using the 1-cyanonaphthalene - biphenyl pair for achieving photooxidation.

Electrophilic Cleavage of Cyclopropanes. Acetolysis of Bicyclic and Tricyclic Cyclopropanes

Wiberg, Kenneth B.,Kass, Steven R.,Meijere, Armin de,Bishop, K. C.

, p. 1003 - 1007 (2007/10/02)

The acetolysis of a series of bicycloalkanes and propellanes has been studied.The effect of ring strain, caused by changing ring size or introducing a trans-ring fusion, on the rate and products of the reaction has been examined.No correlation was found between rates of acetolysis and strain energy relief, but with the exception of propellane, there is a rough correlation with ionization potentials.The degree of polarization of the C-C bonds in the presence of a proton correlates very well with reactivity and is a controlling factor for the acetolysis rates.The importance of the energies of unoccupied orbitals with the appropriate symmetry in controlling electron polarization is shown by the large difference in rate of reaction between - and propellanes.

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