5-methyl-1-phenyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole

Base Information

• Chemical Name: 5-methyl-1-phenyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
• CAS No.: 849776-88-1
• Molecular Formula: C16H21BN2O2
• Molecular Weight: 284.166
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID20383625
• Wikidata: Q82175411
• Mol file: 849776-88-1.mol

Synonyms:849776-88-1;5-methyl-1-phenyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole;5-methyl-1-phenyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole;5-Methyl-1-phenylpyrazole-4-boronic acid, pinacol ester;SCHEMBL1758417;DTXSID20383625;5-Methyl-1-phenyl-1H-pyrazole-4-boronic acid, pinacol ester;(5-METHYL-1-PHENYL-1H-PYRAZOL-4-YL)BORONIC ACID PINACOL ESTER;MFCD06797463;AKOS016003851;AB29651;GS-6689;CS-0055090;FT-0765111;Y10239;A863848;J-517740;5-Methyl-1-phenyl-1H-pyrazole- 4-boronic acid pinacol ester;1H-Pyrazole,5-methyl-1-phenyl-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-;1H-Pyrazole,5-methyl-1-phenyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-;5-Methyl-1-phenyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl);-1H-pyrazole;5-methyl-1-phenyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole, AldrichCPR

Chemical Property of 5-methyl-1-phenyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole

Chemical Property:

• Vapor Pressure: 2.19E-06mmHg at 25°C
• Melting Point: 109.5-112 °C
• Refractive Index: 1.543
• Boiling Point: 404.6 °C at 760 mmHg
• Flash Point: 198.5 °C
• PSA: 36.28000
• Density: 1.07 g/cm³
• LogP: 2.47990
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 284.1696081
• Heavy Atom Count: 21
• Complexity: 367

Purity/Quality:

98%,99%, ^*data from raw suppliers

5-Methyl-1-phenyl-1H-pyrazole-4-boronic acid, pinacol ester 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B1(OC(C(O1)(C)C)(C)C)C2=C(N(N=C2)C3=CC=CC=C3)C