3-Ethoxy-4-hydroxy-5-iodobenzonitrile

Base Information

• Chemical Name: 3-Ethoxy-4-hydroxy-5-iodobenzonitrile
• CAS No.: 330462-58-3
• Molecular Formula: C9H8INO2
• Molecular Weight: 289
• DSSTox Substance ID: DTXSID001286625
• Mol file: 330462-58-3.mol

Synonyms:3-ethoxy-4-hydroxy-5-iodobenzonitrile;330462-58-3;Benzonitrile, 3-ethoxy-4-hydroxy-5-iodo-;3-Ethoxy-4-hydroxy-5-iodo-benzonitrile;starbld0046099;Oprea1_648758;DTXSID001286625;MFCD01123036;STK400336;AKOS000304628;CS-0359846;FT-0707287;A18643

Chemical Property of 3-Ethoxy-4-hydroxy-5-iodobenzonitrile

Chemical Property:

• PSA: 53.25000
• LogP: 2.26718
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 288.95998
• Heavy Atom Count: 13
• Complexity: 213

Purity/Quality:

97% ^*data from raw suppliers

3-ETHOXY-4-HYDROXY-5-IODOBENZONITRILE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC1=C(C(=CC(=C1)C#N)I)O

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