Methyl 3-bromo-5-butoxybenzoate

Base Information

• Chemical Name: Methyl 3-bromo-5-butoxybenzoate
• CAS No.: 1261988-65-1
• Molecular Formula: C12H15BrO3
• Molecular Weight: 287.1497
• Hs Code.: 2918990090
• DSSTox Substance ID: DTXSID50682133
• Wikidata: Q82606418
• Mol file: 1261988-65-1.mol

Synonyms:METHYL 3-BROMO-5-BUTOXYBENZOATE;1261988-65-1;Methyl3-bromo-5-butoxybenzoate;DTXSID50682133;MFCD18311871;AKOS015834196;BS-20394

Chemical Property of Methyl 3-bromo-5-butoxybenzoate

Chemical Property:

• PSA: 35.53000
• LogP: 3.41460
• Storage Temp.: Room temperature.
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 286.02046
• Heavy Atom Count: 16
• Complexity: 220

Purity/Quality:

≥95% ^*data from raw suppliers

Methyl3-bromo-5-butoxybenzoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCOC1=CC(=CC(=C1)C(=O)OC)Br