2-[(2-Isopropyl-5-methylphenoxy)methyl]phenylboronic acid

Base Information

• Chemical Name: 2-[(2-Isopropyl-5-methylphenoxy)methyl]phenylboronic acid
• CAS No.: 1072951-87-1
• Molecular Formula: C17H21BO3
• Molecular Weight: 284.16
• Hs Code.: 2931900090
• European Community (EC) Number: 693-422-5
• DSSTox Substance ID: DTXSID00584759
• Wikidata: Q82476471
• Mol file: 1072951-87-1.mol

Synonyms:1072951-87-1;2-[(2-Isopropyl-5-methylphenoxy)methyl]phenylboronic acid;(2-((2-Isopropyl-5-methylphenoxy)methyl)phenyl)boronic acid;[2-[(5-methyl-2-propan-2-ylphenoxy)methyl]phenyl]boronic acid;(2-{[5-Methyl-2-(propan-2-yl)phenoxy]methyl}phenyl)boronic acid;SCHEMBL2558164;DTXSID00584759;XSB95187;MFCD08276821;AKOS010795579;BS-22828;CS-0173976;F87369;(2-((2-Isopropyl-5-methylphenoxy)methyl)phenyl)boronicacid

Chemical Property of 2-[(2-Isopropyl-5-methylphenoxy)methyl]phenylboronic acid

Chemical Property:

• Melting Point: 143-147 °C
• PSA: 49.69000
• LogP: 2.37720
• Storage Temp.: 2-8°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 284.1583747
• Heavy Atom Count: 21
• Complexity: 308

Purity/Quality:

≥95% ^*data from raw suppliers

2-[(2-Isopropyl-5-methylphenoxy)methyl]phenylboronic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(C1=CC=CC=C1COC2=C(C=CC(=C2)C)C(C)C)(O)O