Benzoic acid, 4-[4,5-dicyano-2-(phenylthio)phenoxy]-

Base Information

• Chemical Name: Benzoic acid, 4-[4,5-dicyano-2-(phenylthio)phenoxy]-
• CAS No.: 620175-25-9
• Molecular Formula: C₂₁H₁₂N₂O₃S
• Molecular Weight: 372.404
• DSSTox Substance ID: DTXSID70475903

Synonyms:620175-25-9;Benzoic acid, 4-[4,5-dicyano-2-(phenylthio)phenoxy]-;DTXSID70475903

Chemical Property of Benzoic acid, 4-[4,5-dicyano-2-(phenylthio)phenoxy]-

Chemical Property:

• XLogP3: 4.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 372.05686342
• Heavy Atom Count: 27
• Complexity: 607

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)SC2=C(C=C(C(=C2)C#N)C#N)OC3=CC=C(C=C3)C(=O)O

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