7-Cyanooxindole

Base Information

• Chemical Name: 7-Cyanooxindole
• CAS No.: 380427-40-7
• Molecular Formula: C₉H₆N₂O
• Molecular Weight: 158.159
• Hs Code.: 2933790090
• European Community (EC) Number: 846-388-2
• DSSTox Substance ID: DTXSID60378398
• Wikidata: Q72458700
• ChEMBL ID: CHEMBL4535809
• Mol file: 380427-40-7.mol

Synonyms:7-Cyanooxindole;380427-40-7;2-oxoindoline-7-carbonitrile;2-oxo-1,3-dihydroindole-7-carbonitrile;2-OXO-2,3-DIHYDRO-1H-INDOLE-7-CARBONITRILE;Trospiumchloride;7-cyanooxindole, AldrichCPR;SCHEMBL2075401;CHEMBL4535809;DTXSID60378398;MFCD02179612;AKOS006228601;AB11404;AC-27818;AM807145;AS-43895;CS-0211516;FT-0644539;EN300-255647;2-oxidanylidene-1,3-dihydroindole-7-carbonitrile;A823973;Q-102621;2,3-DIHYDRO-2-OXO-1H-INDOLE-7-CARBONITRILE;Z1201621659

Chemical Property of 7-Cyanooxindole

Chemical Property:

• Vapor Pressure: 2.63E-06mmHg at 25°C
• Refractive Index: 1.632
• Boiling Point: 390.5°Cat760mmHg
• PKA: 12.78±0.20(Predicted)
• Flash Point: 190°C
• PSA: 52.89000
• Density: 1.33g/cm³
• LogP: 1.19088
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 0.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 158.048012819
• Heavy Atom Count: 12
• Complexity: 253

Purity/Quality:

99% ^*data from raw suppliers

7-Cyanooxindole ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi,Xn
• Statements: 22

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C2=C(C(=CC=C2)C#N)NC1=O
• Use Description: 7-Cyanooxindole serves diverse roles in various fields. In the realm of organic synthesis and medicinal chemistry, it plays a pivotal role as a versatile intermediate for the creation of complex molecules and pharmaceutical compounds, contributing to drug discovery and the development of potential therapeutic agents. In the field of chemical research and academia, this compound can be used as a building block for the synthesis of novel compounds, aiding in the exploration of new chemical reactions and mechanisms. Additionally, in the pharmaceutical industry, 7-Cyanooxindole may find applications in the development of drugs targeting specific biological pathways or receptors, potentially leading to the discovery of treatments for various medical conditions. Its applications in medicinal chemistry, chemical research, and drug development underscore its significance in driving innovation, scientific exploration, and potential medical breakthroughs within these diverse domains.