Dichotomitin

Base Information

• Chemical Name: Dichotomitin
• CAS No.: 88509-91-5
• Molecular Formula: C₁₈H₁₄O₈
• Molecular Weight: 358.304
• DSSTox Substance ID: DTXSID10237087
• Nikkaji Number: J1.809.425H
• Wikidata: Q83119167
• Metabolomics Workbench ID: 22557
• Mol file: 88509-91-5.mol

Synonyms:5,3'-dihydroxy-4',5'-dimethoxy-6,7-methylenedioxyisoflavone;dichotomitin

Chemical Property of Dichotomitin

Chemical Property:

• Vapor Pressure: 2.43E-15mmHg at 25°C
• Boiling Point: 607.3oC at 760 mmHg
• PKA: 6.20±0.20(Predicted)
• Flash Point: 225.2oC
• PSA: 107.59000
• Density: 1.522g/cm3
• LogP: 2.61710
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 3
• Exact Mass: 358.06886740
• Heavy Atom Count: 26
• Complexity: 578

Purity/Quality:

HPLC≥98% ^*data from raw suppliers

Dichotomitin 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC(=CC(=C1OC)O)C2=COC3=CC4=C(C(=C3C2=O)O)OCO4