AF toxin III

Base Information

• Chemical Name: AF toxin III
• CAS No.: 108102-62-1
• Molecular Formula: C22H32 O8
• Molecular Weight: 424.4847
• Mol file: 108102-62-1.mol

Synonyms:AF toxin III;108102-62-1;2,4,6-Octatrienoic acid, 8-((2-(2,3-dihydroxy-3-methyl-1-oxobutoxy)-3-methyl-1-oxopentyl)oxy)-8-(2-methyloxiranyl)-

Chemical Property of AF toxin III

Chemical Property:

• Vapor Pressure: 7.33E-16mmHg at 25°C
• Boiling Point: 579.9°C at 760 mmHg
• Flash Point: 193.1°C
• Density: 1.177g/cm³
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 14
• Exact Mass: 424.20971797
• Heavy Atom Count: 30
• Complexity: 693

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C)C(C(=O)OC(C=CC=CC=CC(=O)O)C1(CO1)C)OC(=O)C(C(C)C)O
• Isomeric SMILES: CCC(C)C(C(=O)OC(/C=C/C=C/C=C/C(=O)O)C1(CO1)C)OC(=O)C(C(C)C)O

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