2,5-Thiophenedicarboxaldehyde - ≥95% , CAS No.932-95-6

CAS: 932-95-6 Cat. No.: T122401 Peso molecular: 140.16 Número EC: 627-004-0 PubChem CID: 587784

GRADE & PURITY ≥95%

Synonyms

AC-5193 | 2,5-thiophene dicarboxaldehyde | AM20080613 | 2,5-Thiophenedicarbaldehyde | DTXSID50343151 | 2,5-Thiophenedial | 2,5-Thiophenedicarboxaldehyde, 99% | SCHEMBL178830 | InChI=1/C6H4O2S/c7-3-5-1-2-6(4-8)9-5/h1-4 | Thiophene-2,5-dicarbaldehyde | AKOS

Storage

Room temperature,Argon charged

Shipped In

Normal

Descripción general

2,5-Thiophenedicarboxaldehyde can be prepared from 2,5-bis(chloromethyl)thiophene by the application of Krohnke′s method.
2,5-Thiophenedicarboxaldehyde may be employed in the following studies: · Asymmetric synthesis of bis-homoallylic alcohols. · Synthesis of new symmetrical arylene bisimide derivatives. · As dialdehyde monomer in the synthesis of silicon-containing poly(p-phenylenevinylene)-related copolymers having uniform p-conjugated segment regulated by organosilicon units. · Synthesis of 2,5-bis[2-(5-N-isopropylamidino)benzimidazoyl]thiophene hydrochloride.

Specifications

Sinónimos

AC-5193 | 2, 5-thiophene dicarboxaldehyde | AM20080613 | 2, 5-Thiophenedicarbaldehyde | DTXSID50343151 | 2, 5-Thiophenedial | 2, 5-Thiophenedicarboxaldehyde, 99% | SCHEMBL178830 | InChI=1/C6H4O2S/c7-3-5-1-2-6(4-8)9-5/h1-4 | Thiophene-2, 5-dicarbaldehyde | AKOS

Especificaciones y pureza

≥95%

Condiciones de almacenamiento de almacenamiento

Room temperature, Argon charged

Enviado en

Normal

Pureza

≥95%

Nombres e identificadores

• Pubchem Sid: 504759383
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504759383
• Sonrisas canónicas: C1=C(SC(=C1)C=O)C=O
• IUPAC Name: thiophene-2,5-dicarbaldehyde
• InChIKey: OTMRXENQDSQACG-UHFFFAOYSA-N
• INCHI: 1S/C6H4O2S/c7-3-5-1-2-6(4-8)9-5/h1-4H
• Isómeros SMILES: C1=C(SC(=C1)C=O)C=O
• WGK Alemania: 3
• PubChem CID: 587784
• Peso molecular: 140.16

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Thiophenes
      • Subclass 2,5-disubstituted thiophenes

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Thiophenes
• Subclass: 2,5-disubstituted thiophenes
• Intermediate Tree Nodes: Not available
• Direct Parent: 2,5-disubstituted thiophenes
• Alternative Parents: Aryl-aldehydes Heteroaromatic compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 2,5-disubstituted thiophene - Aryl-aldehyde - Heteroaromatic compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aldehyde - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as 2,5-disubstituted thiophenes. These are organic compounds containing a thiophene that is disubstituted at the C-2, and C5-positions.
• 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

Mecanismos de acción

Propiedades químicas y físicas

• Punto de fusión (°C): 115-117°C
• Peso molecular: 140.160 g/mol
• XLogP3: 1.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 139.993 Da
• Monoisotopic Mass: 139.993 Da
• Topological Polar Surface Area: 62.400 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 110.000
• 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. Zirun Chen, Junlong Huang, Yin Cui, Ruowen Fu.  (2022)  Precisely tailored morphology of polyimine for simple synthesis of metal sulfide/carbon flower-like superstructures.  CARBON,      [PMID:] [10.1016/j.carbon.2022.01.021]

2. Kanagaraj Rajalakshmi, Selvaraj Muthusamy, Meng Xie, Yun-Sik Nam, Byeong-hyeon Lee, Kang-Bong Lee, Yuanguo Xu, Jimin Xie.  (2021)  Fabrication of thiophene decorated side chain entanglement free COFs for highly regenerable mercury extraction.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2021.133149]

3. Baowen Sun, Chunsheng Wang, Shuhua Han, Yongfeng Hu, Lijuan Zhang.  (2016)  Metal-enhanced fluorescence-based multilayer core–shell Ag-nanocube@SiO2@PMOs nanocomposite sensor for Cu2+ detection.  RSC Advances,  6  (66): (61109-61118).  [PMID:] [10.1039/C6RA11598E]

4. Pengyi Guo, Yu-e Shi, Song Shen, Chengyan Zhou, Jingjing Jiang, Zhenguang Wang.  (2024)  Achieving Efficient Room-Temperature Phosphorescence in the Host–Guest System through Covalent-Bond-Strengthened Hydrogen Bonding.  Journal of Physical Chemistry C,      [PMID:] [10.1021/acs.jpcc.4c00285]

5. Guangping Xia, Yipeng Huang, Shi Yu, Bingmei Lai, Zhenyu Li, Guihua Ruan.  (2024)  Facile synthesis of uniform, spherical, nitrogen- and sulfur-rich covalent organic frameworks for efficient extraction of herbicides containing chlorophenyl and acylamino groups.  MICROCHEMICAL JOURNAL,      [PMID:] [10.1016/j.microc.2024.110259]