Alkannan

Base Information

• Chemical Name: Alkannan
• CAS No.: 517-90-8
• Molecular Formula: C16H18O4
• Molecular Weight: 274.31
• Hs Code.: 2914690090
• DSSTox Substance ID: DTXSID90199654
• Nikkaji Number: J156.599K
• Wikidata: Q27278359
• Mol file: 517-90-8.mol

Synonyms:Alkannan;Alkanna;517-90-8;5,8-dihydroxy-2-(4-methylpentyl)naphthalene-1,4-dione;SCHEMBL12810826;DTXSID90199654;Q27278359

Chemical Property of Alkannan

Chemical Property:

• PSA: 74.60000
• LogP: 3.22950
• XLogP3: 4.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 274.12050905
• Heavy Atom Count: 20
• Complexity: 424

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)CCCC1=CC(=O)C2=C(C=CC(=C2C1=O)O)O