Isooctyl acrylate - ≥90%, contains ＜125 ppm MEHQ as inhibitor , CAS No.29590-42-9

CAS: 29590-42-9 Cat. No.: I303355 Molecular Weight: 184.28 EC Number: 249-707-8

GRADE & PURITY ≥90%, contains ＜125 ppm MEHQ as inhibitor

Synonyms

2-Propenoic acid, 6-methylheptyl ester | NCGC00259895-01 | DSSTox_CID_7955 | FT-0653945 | NCGC00254483-01 | Q27279281 | EINECS 249-707-8 | BS-47595 | AI3-28217 | F76157 | ISOOCTYL ACRYLATE [II] | Isooctyl acrylate, contains 75-125 ppm monomethyl ether hyd

Storage

Protected from light,Room temperature,Argon charged

Shipped In

FedEx DG Service

Overview

application：

Isooctyl acrylate may be used to prepare linear copolymers with cinnamoyloxyethyl methacrylate (CEMA) for applications as oil absorbents. Copolymer of isooctyl acrylate /acrylamine (1:1 mole ratio) was studied as a magnetoelastic CO2 sensor With high sensitivity. Isooctyl acrylate (IOA) based copolymers may be used to prepare pressure-sensitive acrylic medical grade adhesives for skin.

Specifications

Synonyms

2-Propenoic acid, 6-methylheptyl ester | NCGC00259895-01 | DSSTox_CID_7955 | FT-0653945 | NCGC00254483-01 | Q27279281 | EINECS 249-707-8 | BS-47595 | AI3-28217 | F76157 | ISOOCTYL ACRYLATE [II] | Isooctyl acrylate, contains 75-125 ppm monomethyl ether hyd

Specifications & Purity

≥90%, contains ＜125 ppm MEHQ as inhibitor

Storage

Protected from light, Room temperature, Argon charged

Shipped In

FedEx DG Service

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥90%

Names and Identifiers

• Pubchem Sid: 504757580
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504757580
• Canonical Smiles: CC(C)CCCCCOC(=O)C=C
• IUPAC Name: 6-methylheptyl prop-2-enoate
• InChIKey: DXPPIEDUBFUSEZ-UHFFFAOYSA-N
• INCHI: 1S/C11H20O2/c1-4-11(12)13-9-7-5-6-8-10(2)3/h4,10H,1,5-9H2,2-3H3
• Isomeric SMILES: CC(C)CCCCCOC(=O)C=C
• WGK Germany: 2
• RTECS: UD3391000
• Molecular Weight: 184.28
• Reaxy-Rn: 10248750
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=10248750&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Carboxylic acids and derivatives
      • Subclass Acrylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Acrylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Acrylic acid esters
• Alternative Parents: Enoate esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Acrylic acid ester - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as acrylic acid esters. These are organic compounds containing and ester acrylic acid (CH2=CHC(=O)OH).
• 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

Associated Targets(Human)

RXRA Tclin Retinoid X receptor alpha (3637 Activities)

Discover Target: RXRA

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

Mechanisms of Action

Chemical and Physical Properties

• Sensitivity: Light sensitive；Moisture sensitive
• Refractive Index: 1.437 (lit.)
• Flash Point(°F): 194 - 195.8 °F
• Flash Point(°C): 90 - 91 °C
• Boil Point(°C): 125 °C/20 mmHg(lit.)
• Molecular Weight: 184.270 g/mol
• XLogP3: 4.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 8
• Exact Mass: 184.146 Da
• Monoisotopic Mass: 184.146 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 150.000
• 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

References

1. Mao Yang, Chunxia Wang, Xingxiang Ji, Xugang Dang.  (2025)  Leather Solid Waste–Derived Collagen Polypeptide Based Foam for the Sustainable and Clean Production of Foam-Based Extinguishing Agents.  Advanced Sustainable Systems,      [PMID:] [10.1002/adsu.202400963]

2. Jinbiao Min, Jinqing Qu.  (2024)  Optically clear pressure-sensitive adhesive with flexible crosslinking agent for high recovery efficiency, low energy storage modulus, and excellent folding resistance.  POLYMERS FOR ADVANCED TECHNOLOGIES,  35  (9): (e6574).  [PMID:] [10.1002/pat.6574]

3. Wenlu Wang, Yi Jing.  (2024)  Preparation of double-effect water-proof and oil-proof paper based on carboxylated nanocellulose emulsified acrylate polymer.  INDUSTRIAL CROPS AND PRODUCTS,      [PMID:] [10.1016/j.indcrop.2024.118995]

4. Xiaoxue Ai, Xiaoping Wang.  (2024)  Properties and Mechanism of Friction-Reducing Silicone Rubber Modified with Hyperbranched Polysiloxane.  MACROMOLECULAR CHEMISTRY AND PHYSICS,  225  (17): (2400083).  [PMID:] [10.1002/macp.202400083]

5. Jianzhong Ma, Chongxin An, Lei Zhang.  (2025)  Long-Term Antibacterial and Antimildew Polyacrylate-Based TCS@ZIF-8 Leather Coatings Based on Encapsulation and Slow-Release Effects.  ACS Applied Materials & Interfaces,      [PMID:40314643] [10.1021/acsami.5c02719]

6. Ziqi Luo, Xiaojun Wang, Jinxing Song, Pengju Pan, Yongzhong Bao.  (2025)  Fluorinated Ionic Elastomer with Excellent Damping Performance, High Gauge Factor, and Temperature Coefficient of Resistance.  ACS Applied Polymer Materials,      [PMID:] [10.1021/acsapm.5c02780]