1H-Isoindol-1-one, 2,3-dihydro-3-hydroxy-2-phenyl-3-(phenylethynyl)-

Base Information

• Chemical Name: 1H-Isoindol-1-one, 2,3-dihydro-3-hydroxy-2-phenyl-3-(phenylethynyl)-
• CAS No.: 143647-58-9
• Molecular Formula: C22H15NO2
• Molecular Weight: 325.367
• DSSTox Substance ID: DTXSID60394477
• Nikkaji Number: J482.005C
• ChEMBL ID: CHEMBL4584540
• Mol file: 143647-58-9.mol

Synonyms:143647-58-9;1H-Isoindol-1-one, 2,3-dihydro-3-hydroxy-2-phenyl-3-(phenylethynyl)-;2H-448S;3-hydroxy-2-phenyl-3-(2-phenylethynyl)isoindol-1-one;3-hydroxy-2-phenyl-3-(2-phenylethynyl)-2,3-dihydro-1H-isoindol-1-one;Oprea1_496852;3-hydroxy-2-phenyl-3-(2-phenylethynyl)-1-isoindolinone;CHEMBL4584540;DTXSID60394477;AKOS005084952;3-Hydroxy-2-phenyl-3-(phenylethynyl)-2H-isoindol-1(3H)-one

Chemical Property of 1H-Isoindol-1-one, 2,3-dihydro-3-hydroxy-2-phenyl-3-(phenylethynyl)-

Chemical Property:

• XLogP3: 3.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 325.110278721
• Heavy Atom Count: 25
• Complexity: 561

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C#CC2(C3=CC=CC=C3C(=O)N2C4=CC=CC=C4)O

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