3,3-Dimethyl-2,1-benzoxaborol-1(3H)-ol

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Names

[ CAS No. ]:
221352-10-9

[ Name ]:
3,3-Dimethyl-2,1-benzoxaborol-1(3H)-ol

[Synonym ]:
QC-4857
3,3-Gem-Dimethyl Benzoxaborole

Chemical & Physical Properties

[ Density]:
1.1±0.1 g/cm3

[ Boiling Point ]:
242.5±43.0 °C at 760 mmHg

[ Molecular Formula ]:
C9H11BO2

[ Molecular Weight ]:
161.993

[ Flash Point ]:
100.4±28.2 °C

[ Exact Mass ]:
162.085205

[ PSA ]:
29.46000

[ LogP ]:
0.63940

[ Vapour Pressure ]:
0.0±0.5 mmHg at 25°C

[ Index of Refraction ]:
1.531

Safety Information

[ Hazard Codes ]:
Xi

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Triisopropylborate
  • 2-(2-Bromophenyl)-2-propanol
  • Acetone
  • Methyl 2-bromobenzoate
  • 2-Bromophenylboronic acid

DownStream

Related Compounds

  • 5-(Bromomethyl)-3,3-dimethyl-2,1-benzoxaborol-1(3H)-ol
  • 6-Amino-3,3-dimethyl-2,1-benzoxaborol-1(3H)-ol hydrochloride (1:1)
  • 3,3-Dimethyl-6-nitro-2,1-benzoxaborol-1(3H)-ol
  • 3,3,5-Trimethyl-2,1-benzoxaborol-1(3H)-ol
  • 3-(Aminomethyl)-7-(3-hydroxypropoxy)-2,1-benzoxaborol-1(3H)-ol hydrochloride (1:1)
  • Epetraborole hydrochloride