Cas no 40570-19-2 (2-(1-Carboxyethyl)benzoic acid)

2-(1-Carboxyethyl)benzoic acid is a dicarboxylic acid derivative with applications in organic synthesis and pharmaceutical intermediates. Its structure features both aromatic and aliphatic carboxyl groups, enabling versatile reactivity in condensation, esterification, and coordination chemistry. The compound is valued for its role in synthesizing complex molecules due to its bifunctional nature, which facilitates the formation of heterocycles or metal-chelating complexes. It exhibits moderate solubility in polar solvents, enhancing its utility in solution-phase reactions. The presence of two carboxyl groups allows for selective modifications, making it a useful building block in fine chemical and medicinal chemistry research. Proper handling requires standard precautions for carboxylic acids, including avoidance of moisture-sensitive conditions.
2-(1-Carboxyethyl)benzoic acid structure
40570-19-2 structure
Product Name:2-(1-Carboxyethyl)benzoic acid
CAS No:40570-19-2
MF:C10H10O4
MW:194.184003353119
CID:2621092
PubChem ID:6710365
Update Time:2025-10-12

2-(1-Carboxyethyl)benzoic acid Chemical and Physical Properties

Names and Identifiers

    • 2-(1-carboxyethyl)benzoic acid
    • 40570-19-2
    • 2-(1-carboxyethyl)benzoicacid
    • SCHEMBL2517875
    • Methylhomophthalsaure
    • ICCB6_000275
    • BCB03_000132
    • 2-(1-Carboxyethyl)benzoic acid
    • Inchi: 1S/C10H10O4/c1-6(9(11)12)7-4-2-3-5-8(7)10(13)14/h2-6H,1H3,(H,11,12)(H,13,14)
    • InChI Key: JUMCCPMBDOKADY-UHFFFAOYSA-N
    • SMILES: OC(C(C)C1C=CC=CC=1C(=O)O)=O

Computed Properties

  • Exact Mass: 194.05790880g/mol
  • Monoisotopic Mass: 194.05790880g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 236
  • 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
  • XLogP3: 1.5
  • Topological Polar Surface Area: 74.6?2

2-(1-Carboxyethyl)benzoic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
1651934-1g
2-(1-Carboxyethyl)benzoic acid
40570-19-2 98%
1g
¥6269.00 2024-05-14
SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
1651934-5g
2-(1-Carboxyethyl)benzoic acid
40570-19-2 98%
5g
¥17829.00 2024-05-14
SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
1651934-10g
2-(1-Carboxyethyl)benzoic acid
40570-19-2 98%
10g
¥20613.00 2024-05-14
Crysdot LLC
CD12074295-1g
2-(1-Carboxyethyl)benzoic acid
40570-19-2 97%
1g
$460 2024-07-24
Crysdot LLC
CD12074295-5g
2-(1-Carboxyethyl)benzoic acid
40570-19-2 97%
5g
$1136 2024-07-24
Crysdot LLC
CD12074295-10g
2-(1-Carboxyethyl)benzoic acid
40570-19-2 97%
10g
$1642 2024-07-24

Additional information on 2-(1-Carboxyethyl)benzoic acid

2-(1-Carboxyethyl)benzoic Acid: A Comprehensive Overview

2-(1-Carboxyethyl)benzoic acid (CAS No. 40570-19-2) is a compound of significant interest in the fields of organic chemistry and material science. This compound, also referred to as benzoic acid with a carboxyethyl substituent, has garnered attention due to its unique structural properties and potential applications in various industries. Recent studies have highlighted its role in the development of advanced materials, pharmaceuticals, and functional polymers.

The molecular structure of 2-(1-carboxyethyl)benzoic acid consists of a benzoic acid moiety with a carboxyethyl group attached at the second position of the benzene ring. This arrangement imparts the compound with both aromatic and carboxylic acid functionalities, making it versatile for various chemical reactions. The carboxylic acid groups are particularly reactive, enabling the formation of esters, amides, and other derivatives, which are valuable in synthetic chemistry.

Recent research has focused on the synthesis and characterization of 2-(1-carboxyethyl)benzoic acid derivatives. For instance, studies have explored the use of this compound as a building block for synthesizing polymeric materials with enhanced mechanical and thermal properties. The ability to form hydrogen bonds due to the carboxylic acid groups contributes to the formation of robust polymer networks, which are promising for applications in high-performance composites and coatings.

In addition to its role in materials science, 2-(1-carboxyethyl)benzoic acid has shown potential in pharmaceutical applications. Its structure allows for the creation of bioactive molecules with tailored pharmacokinetic properties. Researchers have investigated its derivatives as candidates for drug delivery systems, where the compound's functional groups can be exploited to design targeted drug carriers with improved efficacy and reduced side effects.

The synthesis of 2-(1-carboxyethyl)benboic acid typically involves multi-step organic reactions, including Friedel-Crafts acylation and subsequent oxidation steps. Recent advancements in catalytic methods have enabled more efficient and environmentally friendly syntheses, reducing production costs and minimizing waste. These developments align with current trends toward sustainable chemistry practices.

Moreover, computational studies have provided deeper insights into the electronic properties and reactivity of 2-(1-carboxyethyl)benzoic acid. Density functional theory (DFT) calculations have revealed that the compound exhibits favorable electronic characteristics for use in organic electronics, such as field-effect transistors and photovoltaic devices. Its ability to participate in π-π interactions makes it a candidate for designing novel semiconducting materials.

In conclusion, 2-(1-carboxyethyl)benzoic acid (CAS No. 40570-19-2) is a multifaceted compound with diverse applications across various scientific disciplines. Its unique chemical structure and reactivity continue to drive innovative research, positioning it as a key component in the development of advanced materials and pharmaceuticals. As ongoing studies uncover new possibilities for this compound, its significance in modern chemistry is expected to grow further.

Recommended suppliers
Shenzhen Jianxing Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Shenzhen Jianxing Pharmaceutical Technology Co., Ltd.
Shandong Feiyang Chemical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Shandong Feiyang Chemical Co., Ltd
Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Amadis Chemical Company Limited
Shanghai Pearlk Chemicals Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jiangsu Xinsu New Materials Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jiangsu Xinsu New Materials Co., Ltd