에틸 2-피콜린산염 - ≥98%(GC) , CAS No.2524-52-9

CAS: 2524-52-9 Cat. No.: E133202 분자식: C₈H₉NO₂ 분자량: 151.17 Beilstein Registry Number: 22(3/4)308 EC 번호: 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

보통

개요

에틸 피콜리네이트는 당뇨병 치료에 사용되는 BACE 2 억제제로서 2- 아미노디하이드로[1,3]티아진의 제조에 사용됩니다. 또한 제약 중간체로도 사용됩니다.

Specifications

동의어

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

사양 및 순도

≥98%(GC)

보관 조건

Room temperature

배송

보통

순수함

≥98%(GC)

이름과 식별자

• Pubchem Sid: 504752822
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504752822
• 정식 스마일: 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
• 이성체 SMILES: CCOC(=O)C1=CC=CC=N1
• WGK 독일: 3
• 분자량: 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
    • 분류 Pyridines and derivatives
      • Subclass Pyridinecarboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• 분류: 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
• 설명: 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

관련 대상(비인간)

Thrips tabaci (33 Activities)

Explore this target

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

작용 메커니즘

화학 및 물리적 특성

• 용해성: Fully miscible in water.
• 굴절률: 1.511
• 발화점(°F): 224.6 °F
• 발화점(°C): 107°C(lit.)
• 끓는점(°C): 240-241 °C
• 녹는점(°C): 2°C
• 분자량: 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

참고 문헌

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]

자주 묻는 질문

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.