Barakol

Base Information

• Chemical Name: Barakol
• CAS No.: 24506-68-1
• Molecular Formula: C₁₃H₁₂O₄
• Molecular Weight: 232.236
• Hs Code.: 2932999099
• UNII: EZC4ABS2MU
• DSSTox Substance ID: DTXSID30947398
• Nikkaji Number: J16.705C
• Wikipedia: Barakol
• Wikidata: Q4858279
• ChEMBL ID: CHEMBL2164954
• Mol file: 24506-68-1.mol

Synonyms:2,5-dimethyl-3aH-pyrano(2,3,4-de)-1-benzopyran-3a,8-diol;2,5-dimethyl-8H-pyranol(2,3,4-de)-chromen-8-one;barakol

Chemical Property of Barakol

Chemical Property:

• Vapor Pressure: 6.27E-10mmHg at 25°C
• Boiling Point: 477.6°C at 760 mmHg
• PKA: 8.68±0.60(Predicted)
• Flash Point: 242.6°C
• PSA: 58.92000
• Density: 1.426g/cm³
• LogP: 2.22450
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 232.07355886
• Heavy Atom Count: 17
• Complexity: 400

Purity/Quality:

≥98% （HPLC） ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC2=C3C(=CC(=C2)O)OC(=CC3(O1)O)C

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