3,4-Epoxycyclohexylmethyl 3,4-epoxycyclohexanecarboxylate（EEC） - ≥97% , CAS No.2386-87-0

CAS: 2386-87-0 Cat. No.: E103015 Peso molecular: 252.31 Número EC: 219-207-4

GRADE & PURITY ≥97%

Synonyms

Chissonox 221 monomer | 3,4-Epoxycyclohexylmethyl 3,4-epoxycyclohexane carboxylate | UT-632 | 7-Oxabicyclo[4.1.0]heptan-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate | ERL-4221 | 2386-87-0

Storage

Room temperature

Shipped In

Normal

Descripción general

3,4-Epoxycyclohexylmethyl 3,4-epoxycyclohexanecarboxylate (EEC) is a chemical compound that belongs to the class of cycloaliphatic epoxy resins. It is commonly used as a reactive diluent or a cross-linking agent in the formulation of epoxy-based materials, such as coatings, adhesives, and composites.
It can be synthesized by the reaction of 3′-cyclohexenylmethyl 3-cyclohexenecarboxylate with peracetic acid. Its aliphatic backbone and molecular structure provide a number of useful properties such as thermal stability, weatherability, and electrical conductivity.

Specifications

Sinónimos

Chissonox 221 monomer | 3, 4-Epoxycyclohexylmethyl 3, 4-epoxycyclohexane carboxylate | UT-632 | 7-Oxabicyclo[4.1.0]heptan-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate | ERL-4221 | 2386-87-0

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 488182318
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488182318
• Sonrisas canónicas: C1CC2C(O2)CC1COC(=O)C3CCC4C(C3)O4
• IUPAC Name: 7-oxabicyclo[4.1.0]heptan-3-ylmethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate
• InChIKey: YXALYBMHAYZKAP-UHFFFAOYSA-N
• INCHI: 1S/C14H20O4/c15-14(9-2-4-11-13(6-9)18-11)16-7-8-1-3-10-12(5-8)17-10/h8-13H,1-7H2
• Isómeros SMILES: C1CC2C(O2)CC1COC(=O)C3CCC4C(C3)O4
• WGK Alemania: 1
• RTECS: RN7750000
• Peso molecular: 252.31
• Reaxy-Rn: 1381750
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1381750&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Oxepanes

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Oxepanes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Oxepanes
• Alternative Parents: Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Epoxides Dialkyl ethers Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteropolycyclic compounds
• Substituents: Oxepane - Carboxylic acid ester - Oxacycle - Monocarboxylic acid or derivatives - Ether - Oxirane - Dialkyl ether - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as oxepanes. These are compounds containing an oxepane ring, which is a seven-member saturated aliphatic heterocycle with one oxygen and six carbon atoms.
• 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

Mecanismos de acción

Propiedades químicas y físicas

• Índice de refracción: 1.498
• Punto de inflamación (°C): 118°C
• Punto de fusión (°C): -37°C
• Peso molecular: 252.310 g/mol
• XLogP3: 1.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 252.136 Da
• Monoisotopic Mass: 252.136 Da
• Topological Polar Surface Area: 51.400 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 356.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 6
• 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. Zhongbo Zhu, Shumei Kang, Hua Chen, Qingping Zhao, Zhaokang Huo, Pengyu Li, Qidong Cao, Chenshuo Lu.  (2022)  Preparation and properties of CNTs-Cu hybrids/epoxy superhydrophobic and anticorrosive coatings.  JOURNAL OF INDUSTRIAL AND ENGINEERING CHEMISTRY,      [PMID:] [10.1016/j.jiec.2022.12.007]

2. Zhongbo Zhu, Shumei Kang, Hua Chen, Qingping Zhao, Zhaokang Huo, Pengyu Li, Jian Kang, Yansheng Yin.  (2022)  Construction of superhydrophobic alkyl siloxane-modified carbon nanotubes/epoxy coating.  DIAMOND AND RELATED MATERIALS,      [PMID:] [10.1016/j.diamond.2022.109351]

3. Yue Qin, Mengdi Chen, Jinzhao Li, Yuechuan Wang.  (2022)  Synthesis and properties of cycloaliphatic diepoxides containing fluorinated linker.  JOURNAL OF APPLIED POLYMER SCIENCE,  139  (41): (e52996).  [PMID:] [10.1002/app.52996]

4. Yangyang Xu, Wenlong Tang, Hui Deng, Jianjun Zhang, Zhongquan Zhu, Changjiang Yu, Haiguang Zhu, Ke Sun, Jiazhu Li, Jacques Lalevée.  (2024)  Bisbenzothieno[b]-fused BODIPYs in panchromatic photoinitiation for free radical and cationic photopolymerization and application in 3D printing.  Polymer Chemistry,  15  (47): (4875-4887).  [PMID:] [10.1039/D4PY00926F]

5. Ying Zhang, Mingwei Wang, Ran Zhuo, Wenxu Tang, Chaolu Niu, Qiulin Chen, Weihong Yang, Sicheng Zhao.  (2025)  Study on Self-Healing Technology of Epoxy Resin for Insulator Core Rods.  JOURNAL OF APPLIED POLYMER SCIENCE,      [PMID:] [10.1002/app.56935]

6. Ze Yin, Wenxu Tang, Ke Zhao, Binghao Chen, Jinggang Yang, Lei Sun, Shan Gao, Potao Sun.  (2025)  Smart insulating material with UV-triggered self-healing and aggregation-induced emission-based damage visualization via microcapsules.  MATERIALS LETTERS,      [PMID:] [10.1016/j.matlet.2025.139430]

7. Shaobin Wen, Yao Xu, Liyuan Fan, Bin Peng, Jingyu Zhang, Qiang Zhang, Yulian Pang, Yufei Deng, Yingquan Zou.  (2024)  Hydrophilic coating of membrane by UV-induced radical and cationic curing of photosensitive resins: Lower shrinkage, smoother surface and better anti-fouling performance.  PROGRESS IN ORGANIC COATINGS,      [PMID:] [10.1016/j.porgcoat.2024.108666]

8. Haisheng Wu, Yizhuo Gu, Xinyu Liu, Chaobo Xin.  (2025)  Frontal Polymerization of Epoxy Resins: Kinetic Modeling, Rate Regulation and Curing Process Simulation for Space Manufacturing Applications.  Polymers,  17  (5): (680).  [PMID:40076173] [10.3390/polym17050680]