5-Acetylthiophene-2-boronic acid

Base Information

• Chemical Name: 5-Acetylthiophene-2-boronic acid
• CAS No.: 206551-43-1
• Molecular Formula: C₆H₇BO₃S
• Molecular Weight: 169.997
• Hs Code.: 29310095
• European Community (EC) Number: 681-554-6
• DSSTox Substance ID: DTXSID50399855
• Nikkaji Number: J1.059.507J
• Wikidata: Q72435887
• ChEMBL ID: CHEMBL139713
• Mol file: 206551-43-1.mol

Synonyms:5-Acetylthiophene-2-boronic acid;206551-43-1;5-Acetyl-2-thiopheneboronic acid;5-Acetyl-2-thienylboronic Acid;(5-acetylthiophen-2-yl)boronic Acid;5-acetylthiophen-2-ylboronic acid;(5-acetyl-2-thienyl)boronic acid;MFCD01075681;CHEMBL139713;BORONIC ACID, (5-ACETYL-2-THIENYL)-;5-Acetylthiophene-2-boronicacid;SCHEMBL217943;5-acetylthiophen-2-boronic acid;DTXSID50399855;2-acetyl-thiophen-5-boronic acid;5-acetyl-thiophen-2-boronic acid;DCNMATSPQKWETQ-UHFFFAOYSA-N;2-acetyl-thiophene-5-boronic acid;5-acetyl-thiophene-2-boronic acid;5-Acetyl-2-thiophene boronic acid;5-acetylthiophen-2-yl boronic acid;2-thienyl-1-ethanone5-boronic acid;BBL104140;BDBM50067890;STL557955;(5-acetyl-thiophen-2-yl)boronic acid;(5-acetylthiophen-2-yl)-boronic acid;AKOS004116179;AB08161;CS-W002740;PS-9585;(2-ACETYLTHIEN-5-YL)BORONIC ACID;(5-ACETYLTHIEN-2-YL)BORONIC ACID;AC-33504;SY014694;A4485;AM20090163;FT-0619941;BORONIC ACID, B-(5-ACETYL-2-THIENYL)-;EN300-6729137;J-013493;J-516630;Z1255372963;InChI=1/C6H7BO3S/c1-4(8)5-2-3-6(11-5)7(9)10/h2-3,9-10H,1H

Chemical Property of 5-Acetylthiophene-2-boronic acid

Chemical Property:

• Vapor Pressure: 4.29E-07mmHg at 25°C
• Melting Point: 133-138 ºC
• Refractive Index: 1.556
• Boiling Point: 399.3 ºC at 760 mmHg
• PKA: 7.47±0.53(Predicted)
• Flash Point: 195.3 ºC
• PSA: 85.77000
• Density: 1.34 g/cm³
• LogP: -0.36950
• Storage Temp.: Keep Cold
• Solubility.: soluble in Methanol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 170.0208954
• Heavy Atom Count: 11
• Complexity: 162

Purity/Quality:

99% ^*data from raw suppliers

5-Acetylthiophene-2-boronic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C,Xi
• Statements: 36/37/38
• Safety Statements: 26-36-37

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(C1=CC=C(S1)C(=O)C)(O)O
• Uses: suzuki reaction Reactant for:Bioreduction by alcohol dehydrogenasePreparation of highly fluorescent photochromic dyes by photocyclization reactionsSuzuki-Miyaura cross-couplings