3-Formyl-4-hydroxy-5-bromo-1H-indole-1-carboxylic acid tert-butyl ester

Base Information

• Chemical Name: 3-Formyl-4-hydroxy-5-bromo-1H-indole-1-carboxylic acid tert-butyl ester
• CAS No.: 404888-02-4
• Molecular Formula: C₁₄H₁₄BrNO₄
• Molecular Weight: 340.173
• DSSTox Substance ID: DTXSID301158409
• Nikkaji Number: J1.648.258G

Synonyms:SCHEMBL6304752;DTXSID301158409;1,1-Dimethylethyl 5-bromo-3-formyl-4-hydroxy-1H-indole-1-carboxylate;3-Formyl-4-hydroxy-5-bromo-1H-indole-1-carboxylic acid tert-butyl ester;404888-02-4

Chemical Property of 3-Formyl-4-hydroxy-5-bromo-1H-indole-1-carboxylic acid tert-butyl ester

Chemical Property:

• XLogP3: 3.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 339.01062
• Heavy Atom Count: 20
• Complexity: 395

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)N1C=C(C2=C1C=CC(=C2O)Br)C=O

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