Methyl 10-undecenoate - analytical standard , CAS No.111-81-9

CAS: 111-81-9 Cat. No.: M114416 Peso molecular: 198.3 Número EC: 203-910-8

GRADE & PURITY Analytical standard

Synonyms

undec-10-enoic acid methyl ester | 10-HENDECENOIC ACID METHYL ESTER | CAS-111-81-9 | Methyl 10-Undecenoate(10-Undecenoic Acid Methyl Ester) | 10-Undecenoic acid, methyl ester | STK801278 | HY-W068214 | 10-Hendecenoic acid, methyl ester | Methyl 10-undecen

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinónimos

undec-10-enoic acid methyl ester | 10-HENDECENOIC ACID METHYL ESTER | CAS-111-81-9 | Methyl 10-Undecenoate(10-Undecenoic Acid Methyl Ester) | 10-Undecenoic acid, methyl ester | STK801278 | HY-W068214 | 10-Hendecenoic acid, methyl ester | Methyl 10-undecen

Especificaciones y pureza

analytical standard

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Grado

Analytical standard

Nombres e identificadores

• Sonrisas canónicas: COC(=O)CCCCCCCCC=C
• IUPAC Name: methyl undec-10-enoate
• InChIKey: KISVAASFGZJBCY-UHFFFAOYSA-N
• INCHI: 1S/C12H22O2/c1-3-4-5-6-7-8-9-10-11-12(13)14-2/h3H,1,4-11H2,2H3
• Isómeros SMILES: COC(=O)CCCCCCCCC=C
• WGK Alemania: 3
• Peso molecular: 198.3
• Reaxy-Rn: 1765394
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1765394&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Clase: 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
• Descripción: 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: fatty acid methyl ester

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

Objetivos asociados (humanos)

LMNA Tbio Prelamin-A/C (36751 Activities)

Discover Target: LMNA

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mecanismos de acción

Propiedades químicas y físicas

• Índice de refracción: 1.437
• Punto de inflamación (°F): >100 °C
• Punto de inflamación (°C): >100°C
• Punto de ebullición (°C): 245°C
• Peso molecular: 198.300 g/mol
• XLogP3: 4.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 10
• Exact Mass: 198.162 Da
• Monoisotopic Mass: 198.162 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 152.000
• 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

Referencias

1. Jingjing Fan, Wei Liu, Lieshun Cai, Taoshan Jiang, Zhongkai Wang.  (2023)  Castor oil-based multi-functional monomers and their application in polyamide design.  INDUSTRIAL CROPS AND PRODUCTS,      [PMID:] [10.1016/j.indcrop.2023.117188]

2. Haonan Li, Xiankun Wu, Min Li, Peng Chen, Jiale Zhang, Zhongkai Wang, Zhong Wang.  (2023)  Dynamic sustainable polyamide elastomer toward ultratough and fully recyclable self-healing ionic conductors.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2023.144263]

3. Xiankun Wu, Haonan Li, Peng Chen, Jiale Zhang, Ming Li, Shujun Zhao, Zhongkai Wang, Zhong Wang.  (2023)  Natural-silk-inspired design provides ultra-tough biobased structural adhesives with supercold tolerance.  Journal of Materials Chemistry A,  11  (12): (6286-6298).  [PMID:] [10.1039/D2TA08016H]

4. Li Wang, Haihang Luo, Qiang Gao, Le Jiang, Zhenya Wang, Haojun Fan, Yi Chen, Jun Yan, Jun Xiang.  (2023)  The missing piece: Effect of dangling chains on the synthesis and properties of bio-based waterborne polyurethane.  JOURNAL OF POLYMER SCIENCE,  61  (9): (748-760).  [PMID:] [10.1002/pol.20220690]

5. Wang Li, Xiang Jun, Fan Haojun, Sun Zhe.  (2025)  Hydrophobic high-bio-based content waterborne polyurethane prepared by diols and high-molecular weight internal emulsifier.  Collagen and Leather,  7  (1): (1-15).  [PMID:] [10.1186/s42825-025-00214-9]

6. Li Wang, Jun Xiang, Can Li, Haojun Fan, Zhe Sun.  (2025)  Enhancing corrosion resistance of waterborne polyurethanes by incorporation of side-chain-ester engineered vegetable oil diols.  PROGRESS IN ORGANIC COATINGS,      [PMID:] [10.1016/j.porgcoat.2025.109702]

7. Yongliang Ding, Cheng Liu, Jindong Li, Qingmin Yang, Xi Li, Rui Rong, Siyu Liu, Zhongkai Wang, Xiankun Wu.  (2026)  Renewable bio-based polyamides with programmable thermoplastic-to-thermoset conversion.  POLYMER,      [PMID:] [10.1016/j.polymer.2026.129571]