Hernandalinol

Base Information

• Chemical Name: Hernandalinol
• CAS No.: 62874-90-2
• Molecular Formula: C29H33NO7
• Molecular Weight: 507.5748
• DSSTox Substance ID: DTXSID00212045
• Wikidata: Q83087077

Synonyms:hernandalinol

Chemical Property of Hernandalinol

Chemical Property:

• Vapor Pressure: 2.34E-17mmHg at 25°C
• Boiling Point: 641.9°C at 760 mmHg
• Flash Point: 342°C
• Density: 1.228g/cm³
• XLogP3: 4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 8
• Exact Mass: 507.22570239
• Heavy Atom Count: 37
• Complexity: 741

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CCC2=CC(=C(C3=C2C1CC4=CC(=C(C=C43)OC)OC5=CC(=C(C=C5CO)OC)OC)OC)OC
• Isomeric SMILES: CN1CCC2=CC(=C(C3=C2[C@@H]1CC4=CC(=C(C=C43)OC)OC5=CC(=C(C=C5CO)OC)OC)OC)OC

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