3-Allyloxy-1,2-propanediol - ≥99%(GC) , CAS No.123-34-2

CAS: 123-34-2 Cat. No.: A151103 Molecular Weight: 132.16 EC Number: 204-620-4

GRADE & PURITY ≥99%(GC)

Synonyms

SB83910 | SCHEMBL30534 | Tox21_302125 | 3-(Allyloxy)propane-1,2-diol | PJB18S9URE | Glycerol-1-allyl ether | 3-Allyloxy-1,2-propanediol, 99% | AKOS015916380 | Allyl-.alpha.-glyceryl ether | cyclopropane carbohydrazide | GLYCERYL-.ALPHA.-MONOALLYLETHER

Storage

Room temperature

Shipped In

Normal

Overview

3-Allyloxy-1,2-propanediol(AP) is a multifunctional monomer which contains both allyl and hydroxyl functionalities. The allyl group allows for easy incorporation into polymer chains through various polymerization techniques, including free radical polymerization and thiol-ene reactions. The hydroxyl groups contribute to its solubility in water and compatibility with hydrophilic polymers, enhancing its utility in biomedical applications. It also exhibits high thermal stability.

Specifications

Synonyms

SB83910 | SCHEMBL30534 | Tox21_302125 | 3-(Allyloxy)propane-1, 2-diol | PJB18S9URE | Glycerol-1-allyl ether | 3-Allyloxy-1, 2-propanediol, 99% | AKOS015916380 | Allyl-.alpha.-glyceryl ether | cyclopropane carbohydrazide | GLYCERYL-.ALPHA.-MONOALLYLETHER

Specifications & Purity

≥99%(GC)

Storage

Room temperature

Shipped In

Normal

Purity

≥99%(GC)

Names and Identifiers

• Pubchem Sid: 488185649
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488185649
• Canonical Smiles: C=CCOCC(CO)O
• IUPAC Name: 3-prop-2-enoxypropane-1,2-diol
• InChIKey: PAKCOSURAUIXFG-UHFFFAOYSA-N
• INCHI: 1S/C6H12O3/c1-2-3-9-5-6(8)4-7/h2,6-8H,1,3-5H2
• Isomeric SMILES: C=CCOCC(CO)O
• RTECS: TY2700000
• Molecular Weight: 132.16
• Reaxy-Rn: 1701144
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1701144&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Class Glycerolipids
      • Subclass Glycerol ethers

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Class: Glycerolipids
• Subclass: Glycerol ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Glycerol ethers
• Alternative Parents: Secondary alcohols 1,2-diols Dialkyl ethers Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Glycerol ether - Secondary alcohol - 1,2-diol - Ether - Dialkyl ether - Organic oxygen compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Alcohol - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as glycerol ethers. These are lipids containing an ether derivative of glycerol.
• 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

Chemical and Physical Properties

• Solubility: Solubility in water: Completely miscible; Soluble in Ethanol
• Refractive Index: 1.462
• Flash Point(°F): 134°C
• Flash Point(°C): 134°C
• Boil Point(°C): 142 °C/28 mmHg
• Molecular Weight: 132.160 g/mol
• XLogP3: -0.600
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 132.079 Da
• Monoisotopic Mass: 132.079 Da
• Topological Polar Surface Area: 49.700 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 72.700
• 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

References

1. Yongsheng Zhao, Jialiang Li, Yuqi Ma, Yangwei Wang, Chaobo Jiang, Haonan Yan, Ruosong Hao, Jianbin Qin, Xuetao Shi, Guangcheng Zhang.  (2023)  One-step reactive processing of vitrimeric thermoplastic polyolefin elastomer with greatly improved thermo-mechanical property.  POLYMER,      [PMID:] [10.1016/j.polymer.2023.126185]

2. Zhi Rong Ou, Wei Li Peng, Min Zhi Rong, Ming Qiu Zhang.  (2021)  Controllable Depolymerization and Recovery of Interlocked Covalent Adaptable Networks via Cascading Reactions of the Built-In Reversible Bonds.  MACROMOLECULES,      [PMID:] [10.1021/acs.macromol.1c01737]

3. Chaobo Jiang, Ce Wang, Shilong Zhang, Hongzhe Bi, Yida Wu, Jiafeng Wang, Yanling Zhu, Jianbin Qin, Yongsheng Zhao, Xuetao Shi, Guangcheng Zhang.  (2024)  Reprocessable and self-healable boronic-ester based poly(styrene-b-isoprene-b-styrene) vitrimeric elastomer with improved thermo-mechanical property and adhesive performance.  REACTIVE & FUNCTIONAL POLYMERS,      [PMID:] [10.1016/j.reactfunctpolym.2024.105893]

4. Shilong Zhang, Chaobo Jiang, Ce Wang, Jialiang Li, Yuqi Ma, Yanling Zhu, Hua Deng, Yongsheng Zhao, Guangcheng Zhang.  (2024)  Reprocessable and Self-Healable Boronic-Ester-Based SBS Vitrimers with Improved Thermomechanical Property and Adhesive Performance.  INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH,      [PMID:] [10.1021/acs.iecr.4c02983]

5. Chaobo Jiang, Haonan Yan, Ce Wang, Shilong Zhang, Yanling Zhu, Hua Deng, Yongsheng Zhao, Guangcheng Zhang.  (2025)  Boronic-Ester-Based SBS Vitrimer with a Synergistic Zn2+-Coordinated Network Toward Mechanically Robust and Malleable Elastomers.  INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH,      [PMID:] [10.1021/acs.iecr.5c00982]