6-Chloro-2-ethyl-5,8-dihydroxy-3,7-dimethoxynaphthalene-1,4-dione

Base Information

• Chemical Name: 6-Chloro-2-ethyl-5,8-dihydroxy-3,7-dimethoxynaphthalene-1,4-dione
• CAS No.: 475084-15-2
• Molecular Formula: C14H13ClO6
• Molecular Weight: 312.70200
• DSSTox Substance ID: DTXSID70468118
• Nikkaji Number: J2.278.616D
• Mol file: 475084-15-2.mol

Synonyms:475084-15-2;AGN-PC-00AYX4;DTXSID70468118;5,8-dihydroxy-2,6-dimethoxy-3-chloro-7-ethyl-1,4-naphthoquinone;7-chloro-3-ethyl-5,8-dihydroxy-2,6-dimethoxy-1,4-naphthoquinone

Chemical Property of 6-Chloro-2-ethyl-5,8-dihydroxy-3,7-dimethoxynaphthalene-1,4-dione

Chemical Property:

• PSA: 93.06000
• LogP: 2.44930
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 312.0400658
• Heavy Atom Count: 21
• Complexity: 488

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1=C(C(=O)C2=C(C1=O)C(=C(C(=C2O)Cl)OC)O)OC

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