2-Chloro-3-(propylsulfanyl)naphthalene-1,4-dione

Base Information

• Chemical Name: 2-Chloro-3-(propylsulfanyl)naphthalene-1,4-dione
• CAS No.: 78490-03-6
• Molecular Formula: C13H11ClO2S
• Molecular Weight: 266.74300
• DSSTox Substance ID: DTXSID60508951
• Wikidata: Q82366201

Synonyms:78490-03-6;2-Chloro-3-(propylsulfanyl)naphthalene-1,4-dione;DTXSID60508951

Chemical Property of 2-Chloro-3-(propylsulfanyl)naphthalene-1,4-dione

Chemical Property:

• PSA: 59.44000
• LogP: 3.65920
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 266.0168285
• Heavy Atom Count: 17
• Complexity: 376

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCSC1=C(C(=O)C2=CC=CC=C2C1=O)Cl

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