Cas no 636-01-1 ((2E)-3-(2,5-Dihydroxyphenyl)acrylic Acid)

(2E)-3-(2,5-Dihydroxyphenyl)acrylic Acid is a phenolic derivative featuring both a dihydroxy-substituted aromatic ring and an α,β-unsaturated carboxylic acid moiety. This structure imparts unique reactivity, making it valuable as an intermediate in organic synthesis, particularly for constructing biologically active compounds or functional materials. The presence of hydroxyl groups enhances solubility in polar solvents and facilitates further derivatization, while the conjugated double bond system allows participation in Michael additions or polymerization reactions. Its dual functionality enables applications in pharmaceutical research, such as antioxidant or anti-inflammatory agent development. The compound’s purity and stability are critical for reproducible results in synthetic workflows. Proper storage under inert conditions is recommended to prevent oxidation.
(2E)-3-(2,5-Dihydroxyphenyl)acrylic Acid structure
636-01-1 structure
Product Name:(2E)-3-(2,5-Dihydroxyphenyl)acrylic Acid
CAS No:636-01-1
MF:C9H8O4
MW:180.157423019409
MDL:MFCD00075834
CID:501009
PubChem ID:6442618
Update Time:2025-06-28

(2E)-3-(2,5-Dihydroxyphenyl)acrylic Acid Chemical and Physical Properties

Names and Identifiers

    • (E)-3-(2,5-Dihydroxyphenyl)acrylic acid
    • (2E)-3-(2,5-Dihydroxyphenyl)acrylic acid
    • 2,5-Dihydroxycinnamic acid
    • 2-Propenoic acid,3-(2,5-dihydroxyphenyl)-
    • (2E)-2,5-DIHYDROXYCINNAMIC ACID
    • 2,4-DIHYDROOXYACETOPHENON
    • 2,5-dihydrocinnamic acid
    • 2,5-dihydroxy-cinnamic acid
    • 2,5-Dihydroxy-zimtsaeure
    • 3-(2,5-dihydroxyphenyl)-2-propenoic acid
    • 3-(2,5-Dihydroxy-phenyl)-acrylicacid
    • 5-Hydroxy-cumarsaeure
    • RARECHEM BK HW 0140
    • 3-(2,5-dihydroxyphenyl)acrylic acid
    • 3-(2,5-dihydroxyphenyl)prop-2-enoic acid
    • 2,5-dihydroxystyrylcarbamic acid
    • (2E)-3-(2,5-dihydroxyphenyl)prop-2-enoic acid
    • 2,5-Dihydroxyzimtsaure
    • 2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-, (2E)-
    • BDBM50025476
    • SBB052822
    • AR-683/43306427
    • 38489-67-7
    • trans-2,5-Dihydroxycinnamic acid
    • grevillic acid
    • CS-0266321
    • DTXSID001030505
    • (E)-3-(2,5-dihydroxyphenyl)prop-2-enoic Acid
    • AKOS006345761
    • EN300-1849168
    • CINNAMIC ACID, 2,5-DIHYDROXY-
    • 6EHK92QE99
    • CHEMBL450484
    • SCHEMBL344638
    • 636-01-1
    • 3-(2,5-dihydroxyphenyl)acrylicacid
    • (2E)-3-(2,5-Dihydroxyphenyl)-2-propenoic acid
    • UNII-6EHK92QE99
    • 2,5-DIHYDROXYCINNAMICACID
    • MFCD00075834
    • (e)-2,5-dihydroxycinnamic acid
    • TS-00197
    • Q4596785
    • FT-0610383
    • 2-Propenoic acid, 3-(2,5-dihydroxyphenyl)-
    • AKOS028111155
    • A11070
    • (2E)-3-(2,5-Dihydroxyphenyl)acrylic Acid
    • MDL: MFCD00075834
    • Inchi: 1S/C9H8O4/c10-7-2-3-8(11)6(5-7)1-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-1+
    • InChI Key: JXIPYOZBOMUUCA-DAFODLJHSA-N
    • SMILES: OC1C=CC(=CC=1/C=C/C(=O)O)O

Computed Properties

  • Exact Mass: 180.04200
  • Monoisotopic Mass: 180.042
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 212
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 77.8
  • XLogP3: 1.2

Experimental Properties

  • Density: 1.5±0.1 g/cm3
  • Melting Point: Not available
  • Boiling Point: 457.8±35.0 °C at 760 mmHg
  • Flash Point: 244.8±22.4 °C
  • Refractive Index: 1.706
  • PSA: 77.76000
  • LogP: 1.19560
  • Vapor Pressure: 0.0±1.2 mmHg at 25°C

(2E)-3-(2,5-Dihydroxyphenyl)acrylic Acid Security Information

(2E)-3-(2,5-Dihydroxyphenyl)acrylic Acid Customs Data

  • HS CODE:2918290000
  • Customs Data:

    China Customs Code:

    2918290000

    Overview:

    2918290000 Other carboxylic acids and anhydrides containing phenolic groups but not other oxy groups\Acyl halide\Peroxides and peroxyacids and their derivatives.Regulatory conditions:AB(Customs clearance form for Inbound Goods,Customs clearance form for outbound goods).VAT:17.0%.Tax refund rate:9.0%.MFN tariff:6.5%.general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Regulatory conditions:

    A.Customs clearance form for Inbound Goods
    B.Customs clearance form for outbound goods

    Inspection and quarantine category:

    R.Sanitary supervision and inspection of imported food
    S.Sanitary supervision and inspection of exported food

    Summary:

    HS: 2918290000 other carboxylic acids with phenol function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) VAT:17.0% MFN tariff:6.5% General tariff:30.0%

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(2E)-3-(2,5-Dihydroxyphenyl)acrylic Acid Suppliers

Amadis Chemical Company Limited
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(CAS:636-01-1)(2E)-3-(2,5-Dihydroxyphenyl)acrylic Acid
Order Number:A1168939
Stock Status:in Stock
Quantity:5g/1g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 01:12
Price ($):569.0/176.0

Additional information on (2E)-3-(2,5-Dihydroxyphenyl)acrylic Acid

Chemical Profile of (2E)-3-(2,5-Dihydroxyphenyl)acrylic Acid (CAS No. 636-01-1)

(2E)-3-(2,5-Dihydroxyphenyl)acrylic acid, identified by the Chemical Abstracts Service Number (CAS No.) 636-01-1, is a significant compound in the realm of organic chemistry and pharmaceutical research. This molecule, characterized by its acrylic acid backbone and substituted hydroxyphenyl group, has garnered attention due to its versatile applications and potential in drug development. The presence of two hydroxyl groups on the aromatic ring enhances its reactivity, making it a valuable intermediate in synthesizing various bioactive molecules.

The structure of (2E)-3-(2,5-Dihydroxyphenyl)acrylic acid consists of a conjugated system comprising an acrylic double bond and a phenolic moiety. This configuration allows for multiple functionalization pathways, enabling chemists to tailor its properties for specific applications. The molecule's ability to participate in hydrogen bonding and π-π interactions further extends its utility in medicinal chemistry and material science.

In recent years, research has highlighted the pharmacological significance of (2E)-3-(2,5-Dihydroxyphenyl)acrylic acid. Studies have demonstrated its potential role in modulating inflammatory pathways and antioxidant activities. The hydroxyl groups on the phenyl ring contribute to its ability to scavenge free radicals, which is crucial in preventing oxidative stress-related diseases. Furthermore, the acrylic acid moiety can be further functionalized to develop novel therapeutic agents targeting neurological disorders, cancer, and cardiovascular diseases.

One of the most compelling aspects of (2E)-3-(2,5-Dihydroxyphenyl)acrylic acid is its role as a precursor in synthesizing complex pharmacophores. Researchers have leveraged this compound to develop inhibitors of enzymes such as lipoxygenase and cyclooxygenase, which are pivotal in inflammatory responses. The structural features of this molecule allow for selective binding to target proteins, minimizing side effects associated with non-specific interactions.

Advances in computational chemistry have also facilitated the design of derivatives of (2E)-3-(2,5-Dihydroxyphenyl)acrylic acid with enhanced pharmacokinetic properties. Molecular modeling studies have predicted that modifications at the acrylic double bond or the phenolic hydroxyl groups can improve solubility and bioavailability. These insights are guiding experimental efforts to optimize drug candidates for clinical trials.

The synthesis of (2E)-3-(2,5-Dihydroxyphenyl)acrylic acid typically involves phenol derivatives and acrylic acid through condensation reactions. Catalytic methods have been explored to improve yield and purity, ensuring that the final product meets pharmaceutical standards. Green chemistry approaches are also being adopted to minimize waste and energy consumption during production.

In conclusion, (2E)-3-(2,5-Dihydroxyphenyl)acrylic acid (CAS No. 636-01-1) represents a promising compound in pharmaceutical research. Its unique structural features and reactivity make it a valuable building block for developing novel therapeutics. As research continues to uncover new applications and synthetic methodologies, this molecule is poised to play a significant role in addressing global health challenges.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:636-01-1)(2E)-3-(2,5-Dihydroxyphenyl)acrylic Acid
A1168939
Purity:99%/99%
Quantity:5g/1g
Price ($):569.0/176.0
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