2,3-Pyrazinedicarboxylic acid - ≥97% , CAS No.89-01-0

CAS: 89-01-0 Cat. No.: P100816 Peso molecular: 168.11 Beilstein Registry Number: 147982 Número EC: 201-875-3

GRADE & PURITY ≥97%

Synonyms

AC-1922 | AKOS000121437 | EINECS 201-875-3 | 2,3-pyrazine dicarboxylic acid | HY-W017105 | Maybridge1_001780 | NCGC00336204-01 | AB01141154-03 | STK711154 | J-511414 | MFCD00006131 | Pyrazine-2,3-dicarboxylicacid | Z104492896 | BTB 07953 | P0545 | Pyrazin

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

AC-1922 | AKOS000121437 | EINECS 201-875-3 | 2, 3-pyrazine dicarboxylic acid | HY-W017105 | Maybridge1_001780 | NCGC00336204-01 | AB01141154-03 | STK711154 | J-511414 | MFCD00006131 | Pyrazine-2, 3-dicarboxylicacid | Z104492896 | BTB 07953 | P0545 | Pyrazin

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 488183819
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488183819
• Sonrisas canónicas: C1=CN=C(C(=N1)C(=O)O)C(=O)O
• IUPAC Name: pyrazine-2,3-dicarboxylic acid
• InChIKey: ZUCRGHABDDWQPY-UHFFFAOYSA-N
• INCHI: 1S/C6H4N2O4/c9-5(10)3-4(6(11)12)8-2-1-7-3/h1-2H,(H,9,10)(H,11,12)
• Isómeros SMILES: C1=CN=C(C(=N1)C(=O)O)C(=O)O
• WGK Alemania: 3
• RTECS: UQ2500000
• Peso molecular: 168.11
• Beilstein: 147982
• Reaxy-Rn: 147982
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=147982&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Diazines
      • Subclass Pyrazines
        • Level5 Pyrazine carboxylic acids and derivatives
          • Level6 Pyrazine carboxylic acids

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Diazines
• Subclass: Pyrazines
• Intermediate Tree Nodes: Pyrazine carboxylic acids and derivatives
• Direct Parent: Pyrazine carboxylic acids
• Alternative Parents: Dicarboxylic acids and derivatives Heteroaromatic compounds Carboxylic acids Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Pyrazine carboxylic acid - Dicarboxylic acid or derivatives - Heteroaromatic compound - Azacycle - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as pyrazine carboxylic acids. These are heterocyclic compounds containing a pyrazine ring substituted by one or more carboxylic acid groups.
• 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

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Mecanismos de acción

Propiedades químicas y físicas

• Punto de fusión (°C): 188°C
• Peso molecular: 168.110 g/mol
• XLogP3: -0.700
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 168.017 Da
• Monoisotopic Mass: 168.017 Da
• Topological Polar Surface Area: 100.000 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 184.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Referencias

1. Juan Zhang, Bo Jin, Rufang Peng.  (2023)  Construction of cobalt–nickel bimetallic coordination polymers and their catalytic thermal decomposition of ammonium perchlorate.  APPLIED SURFACE SCIENCE,      [PMID:] [10.1016/j.apsusc.2023.158970]

2. Hu Lei, Liu Su, Song Jie, Jiang Yetao, He Aiyong, Xu Jiaxing.  (2019)  Zirconium-Containing Organic–Inorganic Nanohybrid as a Highly Efficient Catalyst for the Selective Synthesis of Biomass-Derived 2,5-Dihydroxymethylfuran in Isopropanol.  Waste and Biomass Valorization,  11  (7): (3485-3499).  [PMID:] [10.1007/s12649-019-00703-z]

3. Tong Yan, Yuqi Liu, Han Chen, Qi Wang, Xinying Wang, Yusi He, Baizhuang Li, Biao Li, Yuebin Feng, Huilong Luo, Wei Li.  (2024)  A highly efficient Co-based catalyst for peroxymonosulfate activation for rapid degradation of RhB over a wide pH range.  INORGANIC CHEMISTRY COMMUNICATIONS,      [PMID:] [10.1016/j.inoche.2024.113199]

4. Juan Zhang, Wanli Chen, Haijian Li, Fengqi Zhao, Jianhua Yi, Bo Jin, Rufang Peng.  (2024)  Preparation of Zn–Co Bimetallic Catalysts and Their Catalytic Properties for Thermal Decomposition of Ammonium Perchlorate.  LANGMUIR,      [PMID:39021329] [10.1021/acs.langmuir.4c00126]

5. Runying Gao, Qingyun Zhao, Birong Zeng, Xinyu Liu, Yiting Xu, Conghui Yuan, Lizong Dai.  (2025)  Waterproof and Reprocessable PVA Vitrimer Films Cross-Linked by Boronic Acid-Functionalized Carbon Dots with Pigment Detection.  ACS Applied Nano Materials,      [PMID:] [10.1021/acsanm.5c00993]

6. Tao Huang, Hong Wu, Ping Qing, Xiaosen Wang, Wei Pan, Liqiong Luo, Rufang Peng, Bo Jin.  (2025)  Green Bismuth Metal-Organic Framework Catalyzing RDX Combustion and Thermal Decomposition.  DALTON TRANSACTIONS,      [PMID:41510626] [10.1039/D5DT01939G]

7. Jiahui Huang, Siyi Wei, Maopu Tu, Weiqi Deng, Le Zhong, Fan Jiang, Zhixin Li, Ray P.S. Han, Xiaoyu Deng, Shaohua Xu, Yingzhou Tao.  (2025)  Uniformly distributed Cu2O/Cu nanoparticles supported on graphite phase carbon: An enhanced peroxidase mimic for total antioxidant capacity assay.  TALANTA,      [PMID:40934628] [10.1016/j.talanta.2025.128798]