Poly(2-ethylhexyl methacrylate) solution - average Mw ~123,000 by GPC, in toluene , CAS No.25719-51-1

CAS: 25719-51-1 Cat. No.: P478250 Summenformel: (C₁₂H₂₂O₂)n

GRADE & PURITY average Mw ~123,000 by GPC, in toluene

Synonyms

EC 211-708-6 | UNII-8Q7XLQ325N | Tox21_303072 | WDQMWEYDKDCEHT-UHFFFAOYSA- | NCGC00259085-01 | 2-Ethylhexyl 2-methylacrylate # | 2-Propenoic acid, 2-methyl-, 2-ethylhexyl ester | Methacrylate, 2-ethylisohexy | (+/-)-2-ethylhexyl methacrylate | 2-Ethyl-1-h

Storage

Room temperature

Übersicht

Description

PEHMA exhibits biomimetic properties. It finds potential application as a flexible hydrogel for ophthalmologic applications.Poly(2-ethylhexyl methacrylate) (PEHMA) may be used to synthesize binary polymeric blends with poly(butyl methacrylate). PEHMA may be utilized in the preparation of PEHMA /carbon black composites for gas sensing. PHEMA-antioxidant conjugate (Quercetin (Q) ) may be prepared for ophthalmologic uses.

Specifications

Synonyme

EC 211-708-6 | UNII-8Q7XLQ325N | Tox21_303072 | WDQMWEYDKDCEHT-UHFFFAOYSA- | NCGC00259085-01 | 2-Ethylhexyl 2-methylacrylate # | 2-Propenoic acid, 2-methyl-, 2-ethylhexyl ester | Methacrylate, 2-ethylisohexy | (+/-)-2-ethylhexyl methacrylate | 2-Ethyl-1-h

Spezifikationen & Reinheit

average Mw ~123,000 by GPC, in toluene

Storage

Room temperature

Namen und Kennungen

• Kanonisches Lächeln: CCCCC(CC)COC(=O)C(=C)C
• IUPAC Name: 2-ethylhexyl 2-methylprop-2-enoate
• InChIKey: WDQMWEYDKDCEHT-UHFFFAOYSA-N
• INCHI: 1S/C12H22O2/c1-5-7-8-11(6-2)9-14-12(13)10(3)4/h11H,3,5-9H2,1-2,4H3
• Isomere SMILES: CCCCC(CC)COC(=O)C(=C)C
• UN-Nummer: 1993BF
• Reaxy-Rn: 1769420
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1769420&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Klasse Carboxylic acids and derivatives
      • Subclass Carboxylic acid derivatives
        • Ebene5 Carboxylic acid esters
          • Ebene6 Alpha,beta-unsaturated carboxylic esters
            • Ebene7 Enoate esters

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Klasse: Carboxylic acids and derivatives
• Subclass: Carboxylic acid derivatives
• Intermediate Tree Nodes: Carboxylic acid esters - Alpha,beta-unsaturated carboxylic esters
• Direct Parent: Enoate esters
• Alternative Parents: Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Enoate ester - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as enoate esters. These are an alpha,beta-unsaturated carboxylic ester of general formula R1C(R2)=C(R3)C(=O)OR4 (R4= organyl compound) in which the ester C=O function is conjugated to a C=C double bond at the alpha,beta position.
• 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

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Flammpunkt (°F): Not applicable
• Flammpunkt (°C): Not applicable
• Schmelzpunkt (°C): Tg−10℃
• Molekulargewicht: 198.300 g/mol
• XLogP3: 4.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 8
• 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: 185.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1