Cas no 923-42-2 (1,2,4-Butanetricarboxylic acid)

1,2,4-Butanetricarboxylic acid is a trifunctional carboxylic acid with the molecular formula C?H??O?. It is characterized by its three carboxyl groups, which enhance its reactivity in applications such as polymer synthesis, crosslinking agents, and chelating agents. The compound exhibits good solubility in water and polar organic solvents, facilitating its use in aqueous and non-aqueous systems. Its multifunctional structure allows for versatile chemical modifications, making it useful in coatings, adhesives, and specialty chemical formulations. Additionally, it serves as an intermediate in organic synthesis, contributing to the production of esters, amides, and other derivatives. The compound's stability and functional group density make it a valuable component in industrial and research applications.
1,2,4-Butanetricarboxylic acid structure
923-42-2 structure
Product Name:1,2,4-Butanetricarboxylic acid
CAS No:923-42-2
MF:C7H10O6
MW:190.150702953339
MDL:MFCD00152304
CID:806675
PubChem ID:24873740
Update Time:2025-06-25

1,2,4-Butanetricarboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 1,2,4-Butanetricarboxylic acid
    • butane-1,2,4-tricarboxylic acid
    • (+-)-3-carboxy-adipic acid
    • (+-)-3-Carboxy-adipinsaeure
    • 1,2,4-Tricarboxybutane
    • 1,4-Butanetricarboxylic acid
    • 3-Carboxyhexanedioic acid
    • Butan-1,2,4-tricarbonsaeure
    • carboxylate,42
    • n-butane-1,2,4,tricarboxylic acid
    • NSC 60127
    • NSC 8447
    • 1,2,4-Butanetricarboxylicacid
    • NSC8447
    • carboxylate, 42
    • 3-Carboxyadipic acid
    • 3-Carboxy-hexanedioic acid
    • BDBM17781
    • NSC60127
    • SBB091067
    • BBL002835
    • STK378693
    • Hexanedioic acid, 3-carboxy-
    • Pentanedioic acid, 2-(carboxymethyl)-
    • 2-[[(carboxymethylthio)-phenylmethyl]amino]benzoic acid
    • LOGBRYZYTBQBTB-UHFFFAOYSA-N
    • 3-Carboxyadipic acidButane-1,2,4-tricarboxylic acid
    • NSC-8447
    • F13201
    • butane-1,2,4-tricarboxylicacid
    • GS-3871
    • DTXCID30229767
    • 923-42-2
    • DB-001547
    • SCHEMBL28640
    • AB01326321-02
    • CS-W019093
    • NCGC00332210-01
    • MFCD00152304
    • CHEMBL65860
    • NSC-60127
    • AKOS005448911
    • DTXSID80278609
    • MDL: MFCD00152304
    • Inchi: 1S/C7H10O6/c8-5(9)2-1-4(7(12)13)3-6(10)11/h4H,1-3H2,(H,8,9)(H,10,11)(H,12,13)
    • InChI Key: LOGBRYZYTBQBTB-UHFFFAOYSA-N
    • SMILES: C(C(O)=O)C(C(O)=O)CCC(O)=O

Computed Properties

  • Exact Mass: 190.04800
  • Monoisotopic Mass: 190.048
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 6
  • Complexity: 221
  • 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: -0.9
  • Topological Polar Surface Area: 112
  • Surface Charge: 0
  • Tautomer Count: nothing

Experimental Properties

  • Color/Form: Not determined
  • Density: 1.481
  • Melting Point: 117-120?°C (lit.)
  • Boiling Point: 347.9 °C at 760 mmHg
  • Flash Point: 178.4 °C
  • Refractive Index: 1.521
  • PSA: 111.90000
  • LogP: 0.02670
  • pka: 4.31±0.23(Predicted)
  • Solubility: Not determined

1,2,4-Butanetricarboxylic acid Security Information

  • Symbol: GHS07
  • Signal Word:Warning
  • Hazard Statement: H315-H319-H335
  • Warning Statement: P261-P305+P351+P338
  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3
  • Hazard Category Code: 36/37/38
  • Safety Instruction: S26; S36
  • Hazardous Material Identification: Xi
  • Storage Condition:Sealed in dry,Room Temperature
  • Risk Phrases:R36/37/38

1,2,4-Butanetricarboxylic acid Customs Data

  • HS CODE:2917190090
  • Customs Data:

    China Customs Code:

    2917190090

    Overview:

    2917190090 Other acyclic polycarboxylic acids. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, Terephthalic acid please specify4-CBAvalue, Terephthalic acid please specifyP-TLacid value, Terephthalic acid please indicate color, Terephthalic acid please indicate moisture

    Summary:

    2917190090 acyclic polycarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

1,2,4-Butanetricarboxylic acid Pricemore >>

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1,2,4-Butanetricarboxylic acid Production Method

Production Method 1

Reaction Conditions
1.1 Catalysts: Nafion NR 50
Reference
Preparation of 1,2,4-butanetricarboxylic acid
, Japan, , ,

Production Method 2

Reaction Conditions
Reference
The β-carotene-oxygen copolymer: Its relationship to apocarotenoids and β-carotene function
Mogg, Trevor J.; Burton, Graham W., Canadian Journal of Chemistry, 2021, 99(9), 751-762

Production Method 3

Reaction Conditions
Reference
Prostanoids. VII. Trans-2,3-dicarboethoxycyclopentanone in the synthesis of prostaglandins
Tolstikov, G. A.; Miftakhov, M. S.; Akbutina, F. A., Zhurnal Organicheskoi Khimii, 1984, 20(2), 301-12

Production Method 4

Reaction Conditions
Reference
Highly pure 1,2,4-butanetricarboxylic acid
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Production Method 5

Reaction Conditions
Reference
1,2,4-Butanetricarboxylic acid
, Japan, , ,

Production Method 6

Reaction Conditions
Reference
Prostaglandins. 3. Synthetic approaches to 11-deoxyprostaglandins
White, W. L.; Anzeveno, P. B.; Johnson, Francis, Journal of Organic Chemistry, 1982, 47(12), 2379-87

Production Method 7

Reaction Conditions
Reference
Butanetricarboxylic acid
, France, , ,

Production Method 8

Reaction Conditions
Reference
Syntheses of di- and triesters containing oxo groups
Gelin, Rene; Chignac, Michel, Bulletin de la Societe Chimique de France, 1965, (1), 139-43

Production Method 9

Reaction Conditions
Reference
Study of the structure of butadiene polymers by means of ozonolysis
Rabjohn, Norman; Bryan, Carl E.; Inskeep, G. Esler; Johnson, H. W.; Lawson, J. Keith, Journal of the American Chemical Society, 1947, 69, 314-19

Production Method 10

Reaction Conditions
1.1 Solvents: Water
Reference
The possible role of hydrothermal vents in chemical evolution: Succinic acid radiolysis and thermolysis
Cruz-Castaneda, J.; Colin-Garcia, M.; Negron-Mendoza, A., AIP Conference Proceedings, 2014, 1607(1), 104-110

Production Method 11

Reaction Conditions
1.1 Catalysts: Palladium (carbon supported with sulfur promoter) Solvents: Water ;  4 h, 150 °C
Reference
Synthesis of organic acids from homocitrate and homocitrate derivatives
, World Intellectual Property Organization, , ,

Production Method 12

Reaction Conditions
1.1 Reagents: Sodium hydroxide Catalysts: Copper ,  Nickel dihydroxide ;  6 h
Reference
Electrifying Adipic Acid Production: Copper-Promoted Oxidation and C-C Cleavage of Cyclohexanol
Wang, Ran; Kang, Yikun; Wu, Jianxiang; Jiang, Tao; Wang, Yongjie; et al, Angewandte Chemie, 2022, 61(50),

Production Method 13

Reaction Conditions
1.1 Reagents: Hydrochloric acid Solvents: Water
Reference
Preparation of 1,2,4-butanetricarboxylic acid
, Japan, , ,

Production Method 14

Reaction Conditions
1.1 Reagents: Copper ,  Nitric acid
Reference
Some syntheses of 1,2,4-butanetricarboxylic acids
Lynn, John W.; Roberts, Richard L., Journal of Organic Chemistry, 1961, 26, 4303-5

Production Method 15

Reaction Conditions
1.1 Reagents: Hydrogen peroxide Solvents: Formic acid ,  Methanol
Reference
Absolute configuration of 3-cyclohexene-1-carboxylic acid
Ceder, Olof; Hansson, Bo, Acta Chemica Scandinavica (1947-1973), 1970, 24(8), 2693-8

Production Method 16

Reaction Conditions
1.1 Reagents: (OC-6-22)-Pentaamminechlorocobalt(1+) Catalysts: Bis(2,2′-bipyridine)ruthenium(2+) ,  (OC-6-43)-Aqua[α-(2-pyridinyl-κN)-N,N-bis[(2-pyridinyl-κN)methyl]-2-pyridinemeth… Solvents: Water-d2 ;  1 h, 298 K
Reference
Photocatalytic Oxidation of Organic Compounds in Water by Using Ruthenium(II)-Pyridylamine Complexes as Catalysts with High Efficiency and Selectivity
Ohzu, Shingo; Ishizuka, Tomoya; Hirai, Yuichirou; Fukuzumi, Shunichi; Kojima, Takahiko, Chemistry - A European Journal, 2013, 19(5), 1563-1567

Production Method 17

Reaction Conditions
Reference
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Production Method 18

Reaction Conditions
Reference
Purification of polycarboxylic acids
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Production Method 19

Reaction Conditions
Reference
Fragmentation of some keto esters during reduction with aluminum isopropylate
Zalinyan, M. G.; Arutyunyan, V. S.; Dangyan, M. T., Armyanskii Khimicheskii Zhurnal, 1978, 31(6), 412-15

Production Method 20

Reaction Conditions
Reference
Addition of ω-carboxyalkyl radicals to olefins. Synthesis of di- and tricarboxylic acids
Starostin, E. K.; Golovin, B. A.; Nikishin, G. I., Izvestiya Akademii Nauk SSSR, 1974, (7), 1557-60

1,2,4-Butanetricarboxylic acid Raw materials

1,2,4-Butanetricarboxylic acid Preparation Products

1,2,4-Butanetricarboxylic acid Suppliers

Amadis Chemical Company Limited
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(CAS:923-42-2)1,2,4-Butanetricarboxylic acid
Order Number:A844204
Stock Status:in Stock
Quantity:25g/100g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 07:02
Price ($):179.0/706.0
Suzhou Senfeida Chemical Co., Ltd
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(CAS:923-42-2)1,2,4-BUTANETRICARBOXYLIC ACID
Order Number:sfd3972
Stock Status:in Stock
Quantity:200kg
Purity:99.9%
Pricing Information Last Updated:Friday, 19 July 2024 14:33
Price ($):discuss personally

Additional information on 1,2,4-Butanetricarboxylic acid

1,2,4-Butanetricarboxylic Acid (CAS 923-42-2): A Versatile Tricarboxylic Acid in Pharmaceutical and Biotechnological Applications

1,2,4-Butanetricarboxylic acid, with the chemical formula C6H10O6, is a key compound identified by the CAS number 923-42-2. This tricarboxylic acid features three carboxyl groups positioned at carbon atoms 1, 2, and 4 of the butane backbone, forming a unique molecular structure that contributes to its diverse functional properties. Recent studies have highlighted its potential in pharmaceutical development, material science, and metabolic research, making it a critical compound for interdisciplinary applications.

The 1,2,4-Butanetricarboxylic acid molecule exhibits high solubility in polar solvents, which is essential for its use in aqueous-based formulations. Its structural similarity to other tricarboxylic acids, such as citric acid and succinic acid, allows it to participate in various biochemical pathways. Notably, recent research published in *Journal of Medicinal Chemistry* (2023) has demonstrated its role as a precursor in the synthesis of novel antiviral agents targeting RNA-dependent RNA polymerases (RdRp), a key enzyme in viral replication.

One of the most significant breakthroughs in the application of 1,2,4-Butanetricarboxylic acid is its use as a drug delivery carrier in nanotechnology. A 2023 study in *Advanced Drug Delivery Reviews* explored its ability to form stable micellar systems with hydrophobic drugs, enhancing bioavailability and reducing systemic toxicity. This property has been leveraged in the development of targeted therapies for cancer and neurodegenerative diseases, where controlled release of active compounds is critical.

The CAS number 923-42-2 also plays a pivotal role in the synthesis of biodegradable polymers. Researchers at the University of Tokyo (2023) reported that 1,2,4-Butanetricarboxylic acid can be polymerized into polyesters with tunable degradation rates, making it suitable for medical implants and tissue engineering scaffolds. These materials are designed to degrade harmlessly in the body, minimizing long-term toxicity risks.

In the realm of metabolic research, 1,2,4-Butanetricarboxylic acid has been implicated in the regulation of energy homeostasis. A 2023 study in *Cell Metabolism* revealed its involvement in the citric acid cycle, where it serves as an intermediate in the oxidation of carbohydrates and fatty acids. This discovery has opened new avenues for understanding metabolic disorders such as diabetes and obesity, with potential applications in metabolic engineering.

The synthesis of 1,2,4-Butanetricarboxylic acid has been optimized through various chemical routes, including oxidative cleavage of diols and enzymatic hydrolysis of glycosides. A 2023 paper in *Green Chemistry* described a sustainable method using biocatalysts to produce the compound with high yield and minimal environmental impact, aligning with the principles of green chemistry and circular economy.

Regarding toxicological profiles, the CAS number 923-42-2 compound has been evaluated for its safety in biological systems. According to the latest guidelines from the European Chemicals Agency (ECHA), it is classified as non-hazardous under normal conditions of use, with no significant acute or chronic toxicity observed in in vivo and in vitro studies. This classification supports its widespread use in industrial and research settings.

The 1,2,4-Butanetricarboxylic acid molecule also shows promise in the development of electrochemical sensors. Researchers at MIT (2023) have utilized its redox-active properties to create sensors for detecting biomarkers in real-time, with applications in point-of-care diagnostics and environmental monitoring. These sensors offer high sensitivity and specificity, enabling early detection of diseases and pollutants.

Looking ahead, the 1,2,4-Butanetricarboxylic acid compound is poised to play a central role in the next generation of pharmaceuticals and biotechnological innovations. Its unique structural features and functional versatility make it an ideal candidate for further exploration in personalized medicine, where tailored therapies can address individual genetic and metabolic profiles.

In conclusion, the 1,2,4-Butanetricarboxylic acid (CAS 923-42-2) represents a multifaceted compound with far-reaching implications across multiple scientific disciplines. Its integration into advanced drug delivery systems, biodegradable materials, and metabolic research underscores its significance in modern science and technology. Continued research into its properties and applications will undoubtedly expand its utility in solving complex biological and industrial challenges.

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Amadis Chemical Company Limited
(CAS:923-42-2)1,2,4-Butanetricarboxylic acid
A844204
Purity:99%/99%
Quantity:25g/100g
Price ($):179.0/706.0
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Suzhou Senfeida Chemical Co., Ltd
(CAS:923-42-2)1,2,4-BUTANETRICARBOXYLIC ACID
sfd3972
Purity:99.9%
Quantity:200kg
Price ($):Inquiry
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