Ethanone, 2-amino-1-(4-bromo-2,5-dimethoxyphenyl)-

Base Information

• Chemical Name: Ethanone, 2-amino-1-(4-bromo-2,5-dimethoxyphenyl)-
• CAS No.: 807631-09-0
• Molecular Formula: C₁₀H₁₂BrNO₃
• Molecular Weight: 274.114
• UNII: W6KJ195I24
• DSSTox Substance ID: DTXSID201045990
• Nikkaji Number: J3.440.346E
• Wikidata: Q15408422
• Wikipedia: %CE%92k-2C-B
• Mol file: 807631-09-0.mol

Synonyms:2-amino-1-(4-bromo-2,5-dimethoxyphenyl)ethan-1-one;bk-2C-B compound

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Chemical Property of Ethanone, 2-amino-1-(4-bromo-2,5-dimethoxyphenyl)-

Chemical Property:

• Boiling Point: 383.8±42.0 °C(Predicted)
• PKA: 6.62±0.29(Predicted)
• PSA: 61.55000
• Density: 1.451±0.06 g/cm3(Predicted)
• LogP: 2.30800
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 273.00006
• Heavy Atom Count: 15
• Complexity: 225

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC(=C(C=C1C(=O)CN)OC)Br