3-Bromo-2-isopropoxy-5-methylphenylboronic acid

Base Information

• Chemical Name: 3-Bromo-2-isopropoxy-5-methylphenylboronic acid
• CAS No.: 870718-01-7
• Molecular Formula: C10H14BBrO3
• Molecular Weight: 272.933
• Hs Code.: 2931900090
• DSSTox Substance ID: DTXSID10400557
• Wikidata: Q82203566
• Mol file: 870718-01-7.mol

Synonyms:3-Bromo-2-isopropoxy-5-methylphenylboronic acid;870718-01-7;(3-Bromo-2-isopropoxy-5-methylphenyl)boronic acid;(3-bromo-5-methyl-2-propan-2-yloxyphenyl)boronic acid;3-BROMO-2-ISOPROPXY-5-METHYLPHENYLBORONIC ACID;SCHEMBL3316427;DTXSID10400557;VJB71801;MFCD04974111;AKOS015834040;AB21479;BP-11430;BS-23060;CS-0174339;D71323;(3-Bromo-2-isopropoxy-5-methylphenyl)boronicacid;A862906

Chemical Property of 3-Bromo-2-isopropoxy-5-methylphenylboronic acid

Chemical Property:

• Vapor Pressure: 3.3E-07mmHg at 25°C
• Melting Point: 96-101 °C(lit.)
• Boiling Point: 402.7°C at 760 mmHg
• PKA: 7.79±0.58(Predicted)
• Flash Point: 197.4°C
• PSA: 49.69000
• Density: 1.42g/cm³
• LogP: 1.22450
• Storage Temp.: 2-8°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 272.02194
• Heavy Atom Count: 15
• Complexity: 201

Purity/Quality:

98%min ^*data from raw suppliers

3-Bromo-2-isopropoxy-5-methylphenylboronic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(C1=CC(=CC(=C1OC(C)C)Br)C)(O)O