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CAS

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5129-58-8

METHYL 12-METHYLTRIDECANOATE is a chemical compound that belongs to the class of organic compounds known as fatty acid methyl esters. It is derived from the process of esterification of a fatty acid with methanol, resulting in the formation of the methyl ester. METHYL 12-METHYLTRIDECANOATE is commonly found in natural fats and oils and is characterized by its sweet, fruity scent with floral nuances.

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  • 5129-58-8 Structure

  • Basic information

    1. Product Name: METHYL 12-METHYLTRIDECANOATE
    2. Synonyms: METHYL ISOMYRISTATE;METHYL 12-METHYLTRIDECANOATE;ISO-TETRADECANOIC METHYL ESTER;ISO C14 METHYL ESTER;12-METHYLTRIDECANOIC ACID METHYL ESTER;Methyl isotetradecanoate (iso-14:0);Methyl 12-methyltrifdecanoate;12-Methyltridecanoic acid methyl ester, Methyl isomyristate
    3. CAS NO:5129-58-8
    4. Molecular Formula: C15H30O2
    5. Molecular Weight: 242.4
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 5129-58-8.mol

  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 281.3 °C at 760 mmHg
    3. Flash Point: 125 °C
    4. Appearance: /Liquid
    5. Density: 0.865 g/cm3
    6. Vapor Pressure: 0.00358mmHg at 25°C
    7. Refractive Index: 1.436
    8. Storage Temp.: 2-8°C
    9. Solubility: N/A
    10. CAS DataBase Reference: METHYL 12-METHYLTRIDECANOATE(CAS DataBase Reference)
    11. NIST Chemistry Reference: METHYL 12-METHYLTRIDECANOATE(5129-58-8)
    12. EPA Substance Registry System: METHYL 12-METHYLTRIDECANOATE(5129-58-8)

  • 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: 5129-58-8(Hazardous Substances Data)

5129-58-8 Usage

Uses

Used in Fragrance Industry:
METHYL 12-METHYLTRIDECANOATE is used as a fragrance ingredient for its sweet, fruity scent with floral nuances. It is commonly used in the production of perfumes, colognes, and other scented products to add a pleasant aroma.
Used in Cosmetic and Personal Care Products:
METHYL 12-METHYLTRIDECANOATE is used as a scent enhancer in various cosmetic and personal care products to provide a pleasant aroma and improve the overall sensory experience for the user.
Used in Flavor and Food Industry:
METHYL 12-METHYLTRIDECANOATE has potential applications in the formulation of flavors and food products due to its pleasant odor profile, contributing to the enhancement of taste and aroma in various food items.

Check Digit Verification of cas no

The CAS Registry Mumber 5129-58-8 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 5,1,2 and 9 respectively; the second part has 2 digits, 5 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 5129-58:
(6*5)+(5*1)+(4*2)+(3*9)+(2*5)+(1*8)=88
88 % 10 = 8
So 5129-58-8 is a valid CAS Registry Number.
InChI:InChI=1/C15H30O2/c1-14(2)12-10-8-6-4-5-7-9-11-13-15(16)17-3/h14H,4-13H2,1-3H3

5129-58-8SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 14, 2017

Revision Date: Aug 14, 2017

1.Identification

1.1 GHS Product identifier

Product name METHYL 12-METHYLTRIDECANOATE

1.2 Other means of identification

Product number -
Other names Tridecanoic acid,12-methyl-,methyl ester

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:5129-58-8 SDS

5129-58-8Downstream Products

5129-58-8Relevant articles and documents

Alkylation of alkenes: Ethylaluminum sesquichloride-mediated hydro-alkyl additions with alkyl chloroformates and di-tert-butylpyrocarbonate

Biermann, Ursula,Metzger, Juergen O.

, p. 10319 - 10330 (2007/10/03)

A general method for the hydro-alkyl addition to the nonactivated C=C double bond of alkenes using alkyl chloroformates (primary, secondary), 12, and di-tert-butylpyrocarbonate, 52, mediated by ethylaluminum sesquichloride (Et3Al2Cl3) has been developed. Reaction of 12 and 52, respectively, with Et3Al2Cl3 gives an alkyl cation which is added to the alkene; hydride transfer to the adduct carbenium ion or, if applicable, 1,2-H shift followed by hydride transfer from Et3Al2Cl3 to the rearranged adduct carbenium ion gives the saturated addition product. The reaction has been applied to 1-alkenes, 2-methyl-1-alkenes, internal double bonds, and to three cyclic alkenes. Special interest has been focused on alkylations of unsaturated fatty compounds, such as oleic acid (2), which are important renewable feedstocks. 2-Methylalkanes, 3-methylalkanes, 2,4-dimethylalkanes, 2,3-dimethylalkanes, 2,2,4-trimethylalkanes, cyclohexylalkanes, and carboxylic acids and esters with the respective branched alkyl chain have been synthesized with good to moderate yields.

Friedel-Crafts alkylation of alkenes: Ethylaluminum sesquichloride induced alkylations with alkyl chloroformates

Biermann, Ursula,Metzger, Juergen O.

, p. 3675 - 3677 (2007/10/03)

The formal addition of propane to nonactivated double bonds can be achieved with isopropyl chloroformate (2) in the presence of Et3Al2Cl3. Thus, a 1:1 mixture of 10-isopropyloctadecanoic acid (3) and the 9- regioisomer is formed from oleic acid (1). The reaction may also be carried out with 1-alkenes by the addition of triethylsilane as a hydride donor.

Synthesis and Absolute Configuration of 2-Hydroxy-12-methyl Tridecanoic Acid

Balzer, Th.,Budzikiewicz, H.

, p. 1367 - 1368 (2007/10/02)

The synthesis of racemic 2-hydroxy-12-methyl tridecanoic acid is described.The absolute configuration of the two enantiomers has been determined by the method of Dale and Mosher. - Keywords: 2-Hydroxy-12-methyl Tridecanoic Acid, Absolute COnfiguration

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