1H-Indole-5-carboxylic acid, 3-iodo-1-methyl-2-phenyl-, ethyl ester

Base Information

• Chemical Name: 1H-Indole-5-carboxylic acid, 3-iodo-1-methyl-2-phenyl-, ethyl ester
• CAS No.: 681259-71-2
• Molecular Formula: C18H16INO2
• DSSTox Substance ID: DTXSID60466744
• Nikkaji Number: J2.033.831H
• Wikidata: Q82293366

Synonyms:681259-71-2;1H-Indole-5-carboxylic acid, 3-iodo-1-methyl-2-phenyl-, ethyl ester;DTXSID60466744

Chemical Property of 1H-Indole-5-carboxylic acid, 3-iodo-1-methyl-2-phenyl-, ethyl ester

Chemical Property:

• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 405.02258
• Heavy Atom Count: 22
• Complexity: 397

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=CC2=C(C=C1)N(C(=C2I)C3=CC=CC=C3)C

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