5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isothiazole

Base Information

• Chemical Name: 5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isothiazole
• CAS No.: 1045809-78-6
• Molecular Formula: C9H14BNO2S
• Molecular Weight: 211.093
• Hs Code.: 2934999090
• European Community (EC) Number: 866-896-8
• DSSTox Substance ID: DTXSID50587917
• Wikidata: Q82480389
• Mol file: 1045809-78-6.mol

Synonyms:1045809-78-6;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)isothiazole;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2-thiazole;Isothiazole-5-boronic acid pinacol ester;Isothazole-5-boronic acid pinacol ester;isothiazol-5-ylboronic acid pinacol ester;Isothiazole, 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-;SCHEMBL1648288;TIMTEC-BB SBB013829;DTXSID50587917;MFCD08061126;STK689431;AKOS005602268;CS-W005323;MCULE-5436695909;SB30362;AS-30232;DB-113479;EN300-1387239;A896203;J-001197;J-516186;Z1269168950;5-(TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1,2-THIAZOLE;Isothiazole,5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-

Chemical Property of 5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isothiazole

Chemical Property:

• Boiling Point: 234.435 °C at 760 mmHg
• PKA: 3.11±0.22(Predicted)
• Flash Point: 95.583 °C
• PSA: 59.59000
• Density: 1.121 g/cm³
• LogP: 1.44230
• Storage Temp.: Sealed in dry,Store in freezer, under -20°C
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 211.0838300
• Heavy Atom Count: 14
• Complexity: 219

Purity/Quality:

97% ^*data from raw suppliers

5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isothiazole ^*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=CC=NS2