Methyl 12-methyltridecanoate - ≥98% , CAS No.5129-58-8

CAS: 5129-58-8 Cat. No.: M276521 Formula: C₁₅H₃₀O₂ Peso molecolare: 242.4 Numero EC: 680-575-8

GRADE & PURITY ≥98%

Synonyms

Methyl isomyristate | Q27274373 | 12-Methyltridecanoic acid methyl ester | DTXSID20199288 | METHYL12-METHYLTRIDECANOATE | SCHEMBL1369741 | METHYL ISOTETRADECANOATE | HY-153936 | FT-0767128 | Methyl 12-methyltridecanoate | UNII-B508508OUJ | Methyl 12-methy

Storage

Store at -20°C,Desiccated

Shipped In

Ice chest + Ice pads

Panoramica

Store at -20°C. Store under desiccating conditions. The product can be stored for up to 12 months.

Specifications

Sinonimi

Methyl isomyristate | Q27274373 | 12-Methyltridecanoic acid methyl ester | DTXSID20199288 | METHYL12-METHYLTRIDECANOATE | SCHEMBL1369741 | METHYL ISOTETRADECANOATE | HY-153936 | FT-0767128 | Methyl 12-methyltridecanoate | UNII-B508508OUJ | Methyl 12-methy

Specifiche e purezza

≥98%

Meccanismi biochimici e fisiologici

iso -Tetradecanoic methyl ester. Possible use as a taxonomic marker, in iso -fatty acid studies, synthesis and as an internal standard. See similar products

Condizioni di conservazione di stoccaggio

Store at -20°C,Desiccated

Spedito in

Ice chest + Ice pads

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Tipo di azione

INHIBITOR

Nota

Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.

Purezza

≥98%

Nomi e identificatori

• Sorrisi canonici: CC(C)CCCCCCCCCCC(=O)OC
• IUPAC Name: methyl 12-methyltridecanoate
• InChIKey: FLESKWMKPOBWDE-UHFFFAOYSA-N
• INCHI: 1S/C15H30O2/c1-14(2)12-10-8-6-4-5-7-9-11-13-15(16)17-3/h14H,4-13H2,1-3H3
• Isomeri SMILES: CC(C)CCCCCCCCCCC(=O)OC
• Peso molecolare: 242.4
• Reaxy-Rn: 1773738
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1773738&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Classe Fatty Acyls
      • Subclass Fatty acid esters

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Classe: Fatty Acyls
• Subclass: Fatty acid esters
• Intermediate Tree Nodes: Not available
• Direct Parent: Fatty acid methyl esters
• Alternative Parents: Methyl esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Fatty acid methyl ester - Methyl ester - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as fatty acid methyl esters. These are compounds containing a fatty acid that is esterified with a methyl group. They have the general structure RC(=O)OR', where R=fatty aliphatic tail or organyl group and R'=methyl group.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Proprietà chimiche e fisiche

• Solubilità: Soluble in ethanol
• Peso molecolare: 242.400 g/mol
• XLogP3: 6.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 12
• Exact Mass: 242.225 Da
• Monoisotopic Mass: 242.225 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 176.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Riferimenti

1. Xinman Hu, Fang-Yuan Chen, Jie Ding, Zihe Zhai, Huang Yang, Liyin Shen, Yang Zhu, Dong-Sheng Guo, Changyou Gao.  (2023)  Supramolecular self-assembled nanoparticles camouflaged with neutrophil membrane to mitigate myocardial ischemia/reperfusion (I/R) injury.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2023.148138]

2. Zhenzhen Yao, Xiaoman He, Mengqiuzi Yin, Han Han, Qiwu Zhang.  (2023)  Mechanochemical remediation of fluoranthene contaminated soil and biotoxicity evaluation.  ENVIRONMENTAL TECHNOLOGY,      [PMID:34962220] [10.1080/09593330.2021.2024271]

3. Zhuo Wang, Xinyue Zhang, Qian Yang, Shuaihua Zhang, Guifen Chang, Xiaohuan Zang, Chun Wang, Zhi Wang.  (2022)  Covalent triazine-based frameworks for efficient solid-phase microextraction of phthalic acid esters from food-contacted plastics.  JOURNAL OF CHROMATOGRAPHY A,      [PMID:36088777] [10.1016/j.chroma.2022.463474]

4. Mo Zhu, Ying Hao, Xun Ma, Lin Feng, Yuanxin Zhai, Yaping Ding, Guosheng Cheng.  (2019)  Construction of a graphene/polypyrrole composite electrode as an electrochemically controlled release system.  RSC Advances,  9  (22): (12667-12674).  [PMID:35515836] [10.1039/C9RA00800D]

5. H.-J. Shen, H. Shi, K. Ma, M. Xie, L.-L. Tang, S. Shen, B. Li, X.-S. Wang, Y. Jin.  (2012)  Polyelectrolyte capsules packaging BSA gels for pH-controlled drug loading and release and their antitumor activity.  Acta Biomaterialia,      [PMID:23271041] [10.1016/j.actbio.2012.12.024]

6. Yanan Wei, Jianming Pan, Xu Yan, Yanli Mao, Yunlei Zhang.  (2024)  Electron Structure Tuned Oxygen Vacancy-Rich AuPd/CeO2 for Enhancing 5-Hydroxymethylfurfural Oxidation.  ChemSusChem,      [PMID:38494446] [10.1002/cssc.202400241]

7. Feifan Cheng, Yue Huang, Danling Mei, Lei Wang, Xueqin Zhao, Biao Huang.  (2024)  Eu-polyaspartic acid based ratiometric fluorescent probes for ultrasensitive and visual detection of tetracycline and copper ions in food samples.  JOURNAL OF FOOD COMPOSITION AND ANALYSIS,      [PMID:] [10.1016/j.jfca.2024.106867]

8. Chao Du, Zhenzhen Hui, Na Li, Kaiyue Liu, Yong Wang, Ping Wang, Shuyang Sun.  (2024)  Investigation of the antioxidative potential of Meretrix meretrix L. derived peptides from simulated gastrointestinal digestion: In vitro and in silico insights.  LWT-FOOD SCIENCE AND TECHNOLOGY,      [PMID:] [10.1016/j.lwt.2024.115939]

9. Junhui Huang, Yanqiu Zhang, Jing Guo, Zhen Yang, Yongping Bai, Gang Gao, Jiaqi Zhu, Bhekie B. Mamba, Huanting Wang, Lu Shao.  (2024)  Thermostable nanofiltration membranes enabling superior hot wastewater purification.  JOURNAL OF MEMBRANE SCIENCE,      [PMID:] [10.1016/j.memsci.2024.123216]

Domande frequenti

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at ?20 °C, desiccated. Keep the container tightly closed with desiccant — the material is moisture-sensitive.

How is this product shipped?

This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 5129-58-8, the molecular formula is C15H30O2, and the molecular weight is 242.4 g/mol. InChIKey FLESKWMKPOBWDE-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.