(3-Tert-butyl-5-methylphenyl)boronic acid

Base Information

• Chemical Name: (3-Tert-butyl-5-methylphenyl)boronic acid
• CAS No.: 193905-93-0
• Molecular Formula: C₁₁H₁₇BO₂
• Molecular Weight: 192.066
• Hs Code.: 2931900090
• European Community (EC) Number: 813-447-9
• DSSTox Substance ID: DTXSID60378358
• Wikidata: Q82167883
• Mol file: 193905-93-0.mol

Synonyms:193905-93-0;(3-tert-butyl-5-methylphenyl)boronic acid;(3-(tert-Butyl)-5-methylphenyl)boronic acid;3-t-Butyl-5-methylphenylboronic acid;(3-T-BUTYL-5-METHYLPHENYL)BORONIC ACID;MFCD03411938;3-(tert-Butyl)-5-methylbenzeneboronic acid;p-Methylphenacylamine;3-tert-butyl-5-methylphenylboronic acid;3-(tert-Butyl)-5-methylphenylboronic Acid;SCHEMBL1542231;DTXSID60378358;XWWPIVKWAIMBMU-UHFFFAOYSA-N;AKOS006230432;AB14294;AS-30140;SY268993;(3-(tert-Butyl)-5-methylphenyl)boronicacid;CS-0175808;FT-0687833;(3-t-butyl-5-methylphenyl)boronic acid, AldrichCPR;Boronic acid,[3-(1,1-dimethylethyl)-5-methylphenyl]-(9ci)

Chemical Property of (3-Tert-butyl-5-methylphenyl)boronic acid

Chemical Property:

• Vapor Pressure: 0.000114mmHg at 25°C
• Melting Point: 158-160 °C
• Refractive Index: 1.509
• Boiling Point: 322.6 °C at 760 mmHg
• PKA: 8.73±0.10(Predicted)
• Flash Point: 148.9 °C
• PSA: 40.46000
• Density: 1.01 g/cm³
• LogP: 0.97230
• Storage Temp.: Keep Cold
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 192.1321599
• Heavy Atom Count: 14
• Complexity: 186

Purity/Quality:

98%min ^*data from raw suppliers

3-t-Butyl-5-methylphenylboronicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi,Xn
• Statements: 36/37/38-41-22
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(C1=CC(=CC(=C1)C(C)(C)C)C)(O)O
• Uses: 3-t-Butyl-5-methylphenylboronic acid