(4-Bromo-2-methoxyphenyl)(pyrrolidin-1-yl)methanone

Base Information

• Chemical Name: (4-Bromo-2-methoxyphenyl)(pyrrolidin-1-yl)methanone
• CAS No.: 1257664-97-3
• Molecular Formula: C12H14BrNO2
• Molecular Weight: 284.14906
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID80681851
• Wikidata: Q82606027
• Mol file: 1257664-97-3.mol

Synonyms:1257664-97-3;5-Bromo-2-(pyrrolidinocarbonyl)anisole;(4-Bromo-2-methoxyphenyl)(pyrrolidin-1-yl)methanone;(4-bromo-2-methoxyphenyl)-pyrrolidin-1-ylmethanone;SCHEMBL17502632;DTXSID80681851;MFCD18087702;AKOS015834761;BS-19961;CS-0208518

Chemical Property of (4-Bromo-2-methoxyphenyl)(pyrrolidin-1-yl)methanone

Chemical Property:

• PSA: 29.54000
• LogP: 2.63160
• Storage Temp.: Room temperature.
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 283.02079
• Heavy Atom Count: 16
• Complexity: 253

Purity/Quality:

98%min ^*data from raw suppliers

5-Bromo-2-(pyrrolidinocarbonyl)anisole ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=CC(=C1)Br)C(=O)N2CCCC2