2-(2-Thienyl)pyridine - ≥97% , CAS No.3319-99-1

CAS: 3319-99-1 Cat. No.: T133377 Molecular Weight: 161.23 Beilstein Registry Number: 508454 EC Number: 222-022-1 PubChem CID: 76832

GRADE & PURITY ≥97%

Synonyms

2-thiophen-2-ylpyridine | 2-thiophen-2-yl-pyridine | 2-thien-2-ylpyridine | EINECS 222-022-1 | p-Trifluoromethyl benzoic acid chloride | 2-(2-thienyl)pyridine;2-(Thiophen-2-yl)pyridine | EN300-103801 | NCGC00246701-01 | .alpha.-Ketocaprylic acid | 2-(Thio

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

2-thiophen-2-ylpyridine | 2-thiophen-2-yl-pyridine | 2-thien-2-ylpyridine | EINECS 222-022-1 | p-Trifluoromethyl benzoic acid chloride | 2-(2-thienyl)pyridine;2-(Thiophen-2-yl)pyridine | EN300-103801 | NCGC00246701-01 | .alpha.-Ketocaprylic acid | 2-(Thio

Specifications & Purity

≥97%

Storage

Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Pubchem Sid: 504755106
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504755106
• Canonical Smiles: C1=CC=NC(=C1)C2=CC=CS2
• IUPAC Name: 2-thiophen-2-ylpyridine
• InChIKey: QLPKTAFPRRIFQX-UHFFFAOYSA-N
• INCHI: 1S/C9H7NS/c1-2-6-10-8(4-1)9-5-3-7-11-9/h1-7H
• Isomeric SMILES: C1=CC=NC(=C1)C2=CC=CS2
• PubChem CID: 76832
• Molecular Weight: 161.23
• Beilstein: 508454

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Pyridines and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Pyridines and derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyridines and derivatives
• Alternative Parents: Thiophenes Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Pyridine - Heteroaromatic compound - Thiophene - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as pyridines and derivatives. These are compounds containing a pyridine ring, which is a six-member aromatic heterocycle which consists of one nitrogen atom and five carbon atoms.
• 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

Associated Targets(non-human)

Plasmodium falciparum (966862 Activities)

Explore this target

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

Mechanisms of Action

Chemical and Physical Properties

• Solubility: Soluble in Methanol
• Boil Point(°C): 140 °C/16 mmHg
• Melt Point(°C): 63 °C
• Molecular Weight: 161.230 g/mol
• XLogP3: 2.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 161.03 Da
• Monoisotopic Mass: 161.03 Da
• Topological Polar Surface Area: 41.100 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 127.000
• 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

References

1. Yuhao Wu, Kang Du, Ce Xu, Xianghong Li, Dingguo Tang.  (2021)  Highly sensitive detection of Hg2+ using ruthenium complex-based probe in water.  JOURNAL OF ORGANOMETALLIC CHEMISTRY,      [PMID:] [10.1016/j.jorganchem.2021.121690]

2. Wei Wu, Jiaen Huang, Yuling Li, Jiaxi Chen, Xiaowei Kuang, Manzhen Ye, Rui Chen, Junli An, Zunnan Huang, Jing Sun.  (2025)  Endoplasmic Reticulum-Targeting Iridium(III) Complexes Induce Pyroptosis and Enhance Immunogenic Cell Death in MDA-MB-231 Cells.  JOURNAL OF MEDICINAL CHEMISTRY,      [PMID:40639936] [10.1021/acs.jmedchem.5c00883]