2-Methylpyridine(NSC 3409) - Standard for GC, ≥99.5%(GC) , CAS No.109-06-8

CAS: 109-06-8 Cat. No.: M108695 分子式: C₆H₇N 分子量: 93.13 Beilstein Registry Number: 104581 EC番号: 203-643-7

GRADE & PURITY Standard for GC, ≥99.5%(GC)

Synonyms

Z104472800 | DTXCID001899 | RCRA waste no. U191 | .alpha.-Methylpyridine | EINECS 203-643-7 | Picoline, .alpha. | EC 203-643-7 | Picoline | PICOLINE, ALPHA | F0001-0192 | Pyridine, 2-methyl- | 2-Mepy | BCP26524 | DTXSID9021899 | Pyridine-2,3,4,5-d4,6-(met

Storage

Protected from light,Room temperature,Argon charged

Shipped In

FedEx DG Service

概要

2-Picoline (2-Methylpyridine) was used to study the electron and proton transfer reactions of lumiflavin using Fourier transform ion cyclotron resonance mass spectrometry.

2-Picoline was used in the synthetic pathway for the production of dearomatized, allylated and C-H bond activated pyridine derivatives.

Specifications

同義語

Z104472800 | DTXCID001899 | RCRA waste no. U191 | .alpha.-Methylpyridine | EINECS 203-643-7 | Picoline, .alpha. | EC 203-643-7 | Picoline | PICOLINE, ALPHA | F0001-0192 | Pyridine, 2-methyl- | 2-Mepy | BCP26524 | DTXSID9021899 | Pyridine-2,3,4,5-d4,6-(met

仕様と純度

Standard for GC, ≥99.5%(GC)

保管条件

Protected from light,Room temperature,Argon charged

入荷

FedEx DG Service

等級

Standard for GC

純度

≥99.5%(GC)

名前と識別子

• パブケム・シド: 508808440
• パブケム・シド・ウル: https://pubchem.ncbi.nlm.nih.gov/substance/508808440
• カノニカル・スマイル: CC1=CC=CC=N1
• IUPAC Name: 2-methylpyridine
• InChIKey: BSKHPKMHTQYZBB-UHFFFAOYSA-N
• INCHI: 1S/C6H7N/c1-6-4-2-3-5-7-6/h2-5H,1H3
• 異性体SMILES: CC1=CC=CC=N1
• WGKドイツ: 1
• RTECS: TJ4900000
• UN番号: 2313
• 包装グループ: III
• 分子量: 93.13
• Beilstein: 104581
• Reaxy-Rn: 104581
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=104581&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • 分類 Pyridines and derivatives
      • Subclass Methylpyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• 分類: Pyridines and derivatives
• Subclass: Methylpyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: Methylpyridines
• Alternative Parents: Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Methylpyridine - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
• 説明: This compound belongs to the class of organic compounds known as methylpyridines. These are organic compounds containing a pyridine ring substituted at one or more positions by a methyl group.
• External Descriptors: methylpyridine

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（人間）

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Discover Target: TBXAS1

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関連ターゲット（非人間）

Chrna3 Neuronal acetylcholine receptor (756 Activities)

Discover Target: Chrna3

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: It is miscible with water and soluble in most organic solvents.
• 感度: Light sensitive；Air sensitive
• 屈折率: 1.501
• 引火点（°F）: 77℉
• 引火点（°C）: 25℃
• 沸点（°C）: 128-129°C
• 融点（°C）: -70°C
• 分子量: 93.130 g/mol
• XLogP3: 1.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 93.0578 Da
• Monoisotopic Mass: 93.0578 Da
• Topological Polar Surface Area: 12.900 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 52.100
• 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