2-Methyl-3-(3,5-diiodo-4-carboxymethoxybenzyl)benzofuran

Base Information

• Chemical Name: 2-Methyl-3-(3,5-diiodo-4-carboxymethoxybenzyl)benzofuran
• CAS No.: 147030-48-6
• Molecular Formula: C18H14I2O4
• Molecular Weight: 548.11000
• UNII: 9YA9HD8JR2
• Nikkaji Number: J1.704.759K
• Wikidata: Q27893049
• Pharos Ligand ID: 3WZMD87PT4PQ
• ChEMBL ID: CHEMBL157885
• Mol file: 147030-48-6.mol

Synonyms:2-methyl-3-(3,5-diiodo-4-carboxymethoxybenzyl)benzofuran;KB 130015;KB-130015;KB130015

Chemical Property of 2-Methyl-3-(3,5-diiodo-4-carboxymethoxybenzyl)benzofuran

Chemical Property:

• PSA: 59.67000
• LogP: 5.00460
• XLogP3: 5.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 547.89815
• Heavy Atom Count: 24
• Complexity: 435

Purity/Quality:

98% ^*data from raw suppliers

2,6-DIIODO-4-[(2-METHYLBENZOFURAN-3-YL)METHYL]-PHENOXYACETIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C2=CC=CC=C2O1)CC3=CC(=C(C(=C3)I)OCC(=O)O)I

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