Cas no 91912-46-8 (2-(Carboxymethyl)-5-oxotetrahydrofuran-2-carboxylic acid)

2-(Carboxymethyl)-5-oxotetrahydrofuran-2-carboxylic acid is a cyclic dicarboxylic acid derivative with a tetrahydrofuran backbone, featuring both carboxyl and carboxymethyl functional groups. This compound is of interest in organic synthesis and pharmaceutical research due to its bifunctional reactivity, enabling its use as a versatile intermediate in the preparation of heterocyclic compounds, chiral building blocks, and bioactive molecules. Its structural rigidity and dual carboxylic acid groups facilitate selective derivatization, making it valuable for applications in asymmetric synthesis and drug development. The product is typically characterized by high purity and stability, ensuring consistent performance in demanding chemical processes.
2-(Carboxymethyl)-5-oxotetrahydrofuran-2-carboxylic acid structure
91912-46-8 structure
Product Name:2-(Carboxymethyl)-5-oxotetrahydrofuran-2-carboxylic acid
CAS No:91912-46-8
MF:C7H8O6
MW:188.134822845459
MDL:MFCD00057274
CID:809064
PubChem ID:13871910
Update Time:2025-06-14

2-(Carboxymethyl)-5-oxotetrahydrofuran-2-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 2-Furanacetic acid,2-carboxytetrahydro-5-oxo-
    • carboxy 2-(5-oxooxolan-2-yl)acetate
    • HOMOCITRIC ACID-GAMMA-LACTONE
    • HOMOCITRIC ACID-G-LACTONE
    • (+/-)-Homocitric acid lactone
    • (S)-homocitric acid lactone
    • 2-carboxymethyl-5-oxo-tetrahydro-furan-2-carboxylic acid
    • Homocitrate lactone
    • Homocitronensaeurelacton
    • 2-(Carboxymethyl)-5-oxotetrahydrofuran-2-carboxylic acid
    • FCH838702
    • AK165556
    • 2-Carboxy-5-oxotetrahydrofuran-2-acetic acid
    • 2-(CARBOXYMETHYL)-5-OXOOXOLANE-2-CARBOXYLIC ACID
    • CS-0161574
    • C77146
    • SCHEMBL13589960
    • FT-0690478
    • A922766
    • AKOS006274359
    • DS-9022
    • MFCD00057274
    • 91912-46-8
    • DB-313865
    • 2-Carboxytetrahydro-5-oxo-2-furanacetic acid
    • MDL: MFCD00057274
    • Inchi: 1S/C7H8O6/c8-4(9)3-7(6(11)12)2-1-5(10)13-7/h1-3H2,(H,8,9)(H,11,12)
    • InChI Key: FMWCVXXCFOTHGM-UHFFFAOYSA-N
    • SMILES: O1C(CCC1(C(=O)O)CC(=O)O)=O

Computed Properties

  • Exact Mass: 188.03200
  • Monoisotopic Mass: 188.032088
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 270
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 101
  • XLogP3: -0.9

Experimental Properties

  • Density: 1.464
  • Boiling Point: 431.1°C at 760 mmHg
  • Flash Point: 183.7°C
  • Refractive Index: 1.495
  • PSA: 100.90000
  • LogP: -0.37850

2-(Carboxymethyl)-5-oxotetrahydrofuran-2-carboxylic acid Security Information

2-(Carboxymethyl)-5-oxotetrahydrofuran-2-carboxylic acid Pricemore >>

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Additional information on 2-(Carboxymethyl)-5-oxotetrahydrofuran-2-carboxylic acid

Comprehensive Guide to 2-(Carboxymethyl)-5-oxotetrahydrofuran-2-carboxylic acid (CAS No. 91912-46-8)

2-(Carboxymethyl)-5-oxotetrahydrofuran-2-carboxylic acid (CAS No. 91912-46-8) is a versatile organic compound with significant applications in pharmaceuticals, agrochemicals, and specialty chemicals. This compound, often referred to by its systematic name, belongs to the class of tetrahydrofuran derivatives, which are known for their unique structural and functional properties. The presence of both carboxylic acid and oxo groups in its structure makes it a valuable intermediate in synthetic chemistry.

In recent years, the demand for 2-(Carboxymethyl)-5-oxotetrahydrofuran-2-carboxylic acid has surged due to its role in the development of biodegradable polymers and green chemistry initiatives. Researchers are increasingly focusing on sustainable alternatives to traditional petrochemical-based compounds, and this molecule fits perfectly into this trend. Its potential as a bio-based platform chemical has attracted attention from industries aiming to reduce their carbon footprint.

The synthesis of 2-(Carboxymethyl)-5-oxotetrahydrofuran-2-carboxylic acid typically involves multi-step organic reactions, including cyclization and oxidation processes. Advanced techniques such as catalytic hydrogenation and enzymatic conversion have been explored to improve yield and purity. These methods align with the growing interest in eco-friendly synthesis and process optimization, which are hot topics in the chemical industry.

One of the most frequently asked questions about CAS No. 91912-46-8 is its solubility and stability under various conditions. Studies indicate that this compound exhibits good solubility in polar solvents like water, methanol, and dimethyl sulfoxide (DMSO). Its stability is influenced by factors such as pH, temperature, and exposure to light, making it essential to store it under controlled conditions. These properties are critical for its application in drug formulation and material science.

The pharmaceutical industry has shown keen interest in 2-(Carboxymethyl)-5-oxotetrahydrofuran-2-carboxylic acid due to its potential as a building block for active pharmaceutical ingredients (APIs). Its structural features allow for the creation of novel heterocyclic compounds, which are often the backbone of many drugs. Additionally, its compatibility with peptide synthesis and prodrug design makes it a valuable asset in medicinal chemistry.

Another area where CAS No. 91912-46-8 is gaining traction is in the field of cosmetic chemistry. Its mild acidity and ability to form stable complexes with metal ions make it suitable for use in skincare formulations. Consumers are increasingly demanding clean beauty products, and this compound's natural origin and low toxicity profile align well with this trend.

From an environmental perspective, 2-(Carboxymethyl)-5-oxotetrahydrofuran-2-carboxylic acid is considered a low-risk compound due to its biodegradability and minimal ecological impact. Regulatory bodies such as the Environmental Protection Agency (EPA) and European Chemicals Agency (ECHA) have classified it as safe for use in various applications, provided proper handling guidelines are followed.

In conclusion, 2-(Carboxymethyl)-5-oxotetrahydrofuran-2-carboxylic acid (CAS No. 91912-46-8) is a multifaceted compound with wide-ranging applications. Its relevance in sustainable chemistry, pharmaceuticals, and cosmetics underscores its importance in modern science. As research continues to uncover new uses for this molecule, its market potential is expected to grow significantly in the coming years.

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