Caff-ol sulfate

Base Information

• Chemical Name: Caff-ol sulfate
• CAS No.: 158080-67-2
• Molecular Formula: C8H8 O6 S
• Molecular Weight: 232.21
• ChEMBL ID: CHEMBL1207918
• Mol file: 158080-67-2.mol

Synonyms:2-(3',4'-dihydroxyphenyl)ethylene sulfate;2-(3',4'-dihydroxyphenyl)ethylene sulfate, (Z)-isomer;caff-ol sulfate

Chemical Property of Caff-ol sulfate

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 112.44000
• Density: 1.711g/cm³
• LogP: 1.96870
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 232.00415914
• Heavy Atom Count: 15
• Complexity: 317

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1C=COS(=O)(=O)O)O)O
• Isomeric SMILES: C1=CC(=C(C=C1/C=C/OS(=O)(=O)O)O)O

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