5-(4-Chlorobenzene-1-sulfinyl)-2,3-dimethoxynaphthalene-1,4-dione

Base Information

• Chemical Name: 5-(4-Chlorobenzene-1-sulfinyl)-2,3-dimethoxynaphthalene-1,4-dione
• CAS No.: 89227-15-6
• Molecular Formula: C18H13ClO5S
• DSSTox Substance ID: DTXSID50532265
• Mol file: 89227-15-6.mol

Synonyms:89227-15-6;SCHEMBL11144428;DTXSID50532265;5-(4-Chlorobenzene-1-sulfinyl)-2,3-dimethoxynaphthalene-1,4-dione

Chemical Property of 5-(4-Chlorobenzene-1-sulfinyl)-2,3-dimethoxynaphthalene-1,4-dione

Chemical Property:

• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 376.0172224
• Heavy Atom Count: 25
• Complexity: 609

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C(=O)C2=C(C1=O)C=CC=C2S(=O)C3=CC=C(C=C3)Cl)OC