4,5,6,7-Tetrachloro-2-naphthalen-1-ylisoindole-1,3-dione

Base Information

• Chemical Name: 4,5,6,7-Tetrachloro-2-naphthalen-1-ylisoindole-1,3-dione
• CAS No.: 77106-26-4
• Molecular Formula: C18H7Cl4NO2
• Molecular Weight: 411.06600
• ChEMBL ID: CHEMBL4203406
• DSSTox Substance ID: DTXSID40404083
• Wikidata: Q82208066

Synonyms:STK247422;77106-26-4;SCHEMBL1813210;CHEMBL4203406;DTXSID40404083;AKOS003243472

Chemical Property of 4,5,6,7-Tetrachloro-2-naphthalen-1-ylisoindole-1,3-dione

Chemical Property:

• PSA: 37.38000
• LogP: 6.31900
• XLogP3: 6.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 410.920139
• Heavy Atom Count: 25
• Complexity: 541

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C=CC=C2N3C(=O)C4=C(C3=O)C(=C(C(=C4Cl)Cl)Cl)Cl

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