3-Amino-5-bromo-4-methoxy-benzoic acid methyl ester

Base Information

• Chemical Name: 3-Amino-5-bromo-4-methoxy-benzoic acid methyl ester
• CAS No.: 40258-74-0
• Molecular Formula: C9H10BrNO3
• Molecular Weight: 260.08
• DSSTox Substance ID: DTXSID20679530

Synonyms:40258-74-0;3-Amino-5-bromo-4-methoxy-benzoic acid methyl ester;methyl 3-amino-5-bromo-4-methoxybenzoate;MFCD16039459;DTXSID20679530;AKOS012321777;3-Amino-5-bromo-4-methoxy-benzoicacidmethylester

Chemical Property of 3-Amino-5-bromo-4-methoxy-benzoic acid methyl ester

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• PKA: 2.32±0.10(Predicted)
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 258.98441
• Heavy Atom Count: 14
• Complexity: 212

Purity/Quality:

99% ^*data from raw suppliers

Methyl 3-amino-5-bromo-4-methoxybenzoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC1=C(C=C(C=C1Br)C(=O)OC)N

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