Ethyl 2-picolinate - ≥98%(GC) , CAS No.2524-52-9

CAS: 2524-52-9 Cat. No.: E133202 分子式: C₈H₉NO₂ 分子量: 151.17 Beilstein Registry Number: 22(3/4)308 EC番号: 219-758-0

GRADE & PURITY ≥98%(GC)

Synonyms

Ethyl 2-picolinate, purum, >=99.0% (GC) | F0001-0852 | SCHEMBL126181 | STL558973 | STR01170 | UNII-RW5EU98AZQ | ETHYL PICOLINATE | FS-3192 | Ethyl2-picolinate | BCP25791 | Ethyl 2-picolinate | FT-0622196 | AM20050998 | Ethyl 2-picolinate, 99% | Picolinic

Storage

Room temperature

Shipped In

Normal

概要

Ethyl picolinate is used in the preparation of 2-Aminodihydro[1,3]thiazines as BACE 2 inhibitors which is used in the treatment of diabetes. It is also used as pharmaceutical intermediate.

Specifications

同義語

Ethyl 2-picolinate, purum, >=99.0% (GC) | F0001-0852 | SCHEMBL126181 | STL558973 | STR01170 | UNII-RW5EU98AZQ | ETHYL PICOLINATE | FS-3192 | Ethyl2-picolinate | BCP25791 | Ethyl 2-picolinate | FT-0622196 | AM20050998 | Ethyl 2-picolinate, 99% | Picolinic

仕様と純度

≥98%(GC)

保管条件

Room temperature

入荷

Normal

純度

≥98%(GC)

名前と識別子

• パブケム・シド: 504752822
• パブケム・シド・ウル: https://pubchem.ncbi.nlm.nih.gov/substance/504752822
• カノニカル・スマイル: CCOC(=O)C1=CC=CC=N1
• IUPAC Name: ethyl pyridine-2-carboxylate
• InChIKey: FQYYIPZPELSLDK-UHFFFAOYSA-N
• INCHI: 1S/C8H9NO2/c1-2-11-8(10)7-5-3-4-6-9-7/h3-6H,2H2,1H3
• 異性体SMILES: CCOC(=O)C1=CC=CC=N1
• WGKドイツ: 3
• 分子量: 151.17
• Beilstein: 22(3/4)308
• Reaxy-Rn: 122485
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=122485&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • 分類 Pyridines and derivatives
      • Subclass Pyridinecarboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• 分類: Pyridines and derivatives
• Subclass: Pyridinecarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyridinecarboxylic acids
• Alternative Parents: Heteroaromatic compounds Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Pyridine carboxylic acid - Heteroaromatic compound - Carboxylic acid ester - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
• 説明: This compound belongs to the class of organic compounds known as pyridinecarboxylic acids. These are compounds containing a pyridine ring bearing a carboxylic acid group.
• 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

関連ターゲット（非人間）

Thrips tabaci (33 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

作用メカニズム

化学的性質と物理的性質

• 溶解度: Fully miscible in water.
• 屈折率: 1.511
• 引火点（°F）: 224.6 °F
• 引火点（°C）: 107°C(lit.)
• 沸点（°C）: 240-241 °C
• 融点（°C）: 2°C
• 分子量: 151.160 g/mol
• XLogP3: 0.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 151.063 Da
• Monoisotopic Mass: 151.063 Da
• Topological Polar Surface Area: 39.200 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 136.000
• 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

参考文献

1. Xianglong Lei, Jun Tan, Pengfei Zhu, Chaozhen Zheng, Yao Liu, Le Zhang, Jun Luo, Jiugang Hu.  (2024)  Bidentate pyridine-pyrazole ligand-induced synergistic and antagonistic effects for selective separation of nickel from sulfuric acid medium.  SEPARATION AND PURIFICATION TECHNOLOGY,      [PMID:] [10.1016/j.seppur.2024.129188]

2. Xianglong Lei, Jun Tan, Yao Liu, Le Zhang, Pengfei Zhu, Jun Luo, Jiugang Hu.  (2025)  Dual Synergistic/Antagonistic Mechanism of Protonated-Amino Bidentate Ligand for Selective Separation of Nickel and Cobalt under High Acidity.  INORGANIC CHEMISTRY,      [PMID:41051885] [10.1021/acs.inorgchem.5c03830]

よくある質問

What is the purity of this product, and how is it determined?

This product is supplied at ≥98% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 2524-52-9, the molecular formula is C8H9NO2, and the molecular weight is 151.17 g/mol. InChIKey FQYYIPZPELSLDK-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.