3-Chloro-5-isobutoxyphenylboronic acid

Base Information

• Chemical Name: 3-Chloro-5-isobutoxyphenylboronic acid
• CAS No.: 1256345-48-8
• Molecular Formula: C10H14BClO3
• Molecular Weight: 228.48036
• Hs Code.: 2931900090
• DSSTox Substance ID: DTXSID40681519
• Wikidata: Q82605590
• Mol file: 1256345-48-8.mol

Synonyms:1256345-48-8;3-CHLORO-5-ISOBUTOXYPHENYLBORONIC ACID;(3-Chloro-5-isobutoxyphenyl)boronic acid;[3-chloro-5-(2-methylpropoxy)phenyl]boronic acid;(3-Chloro-5-isobutoxyphenyl)boronicacid;DTXSID40681519;MFCD16660268;AKOS015848996;BS-19710;CS-0174428

Chemical Property of 3-Chloro-5-isobutoxyphenylboronic acid

Chemical Property:

• Boiling Point: 380.2±52.0 °C(Predicted)
• PKA: 7.13±0.10(Predicted)
• PSA: 49.69000
• Density: 1.19±0.1 g/cm3(Predicted)
• LogP: 1.05460
• Storage Temp.: Room temperature.
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 228.0724522
• Heavy Atom Count: 15
• Complexity: 190

Purity/Quality:

≥95% ^*data from raw suppliers

3-Chloro-5-isobutoxyphenylboronicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(C1=CC(=CC(=C1)Cl)OCC(C)C)(O)O