1-Methyl-3,3-diphenyltetrahydro-3H-pyrrolo[1,2-c][1,3,2]oxazaborole | CAS No. 133261-83-3

1-Methyl-3,3-diphenyltetrahydro-3H-pyrrolo[1,2-c][1,3,2]oxazaborole

Basic Information

CAS Number

133261-83-3

Molecular Formula

C18H20BNO

Molecular Weight

277.18 g/mol

AD

Basic Physical Properties

Melting Point

85-95 °C

Boiling Point

111 °C

Flash Point

40 °F

B1(N2CCCC2C(O1)(c3ccccc3)c4ccccc4)C

InChI

InChI=1S/C18H20BNO/c1-19-20-14-8-13-17(20)18(21-19,15-9-4-2-5-10-15)16-11-6-3-7-12-16/h2-7,9-12,17H,8,13-14H2,1H3

InChIKey

VMKAFJQFKBASMU-UHFFFAOYSA-N

LogP

3.5428000000000024

Topological Polar Surface Area

12.47 Ų

Hydrogen Bond Donor/Acceptor

0 / 2

Synonyms & References

English

  • (R)-3,3-diphenyl-1-methyltetrahydro-3H-pyrrolo-oxazaborole
  • (R)-3,3-Diphenyl-1-methyltetrahydro-3H-pyrrolo[1,2-c][1,3,2]oxazaborole
  • (R)-ME CBS
  • (R)-METHYL OXAZABOROLIDINE
  • (R)-2-METHYL-CBS-OXAZABOROLIDINE MONOHYDRATE
  • (R)-5,5-DIPHENYL-2-METHYL-3,4-PROPANO-1,3,2-OXAZABOROLIDINE
  • ALPHA,ALPHA-DIPHENYL-D-PROLINOL METHYLBORONIC ACID CYCL-AMIDE-ESTER
  • (R)-1-METHYL,3,3-DIPHENYL-TETRAHYDRO-PYRROLO(1,2-C)(1,3,2)OXAZABOROLE
  • (R)-3,3-DIPHENYL-1-METHYLTETRAHYDRO-3H-PYRROLO-[1,2-C][1,3,2]OXAZABOROLE
  • (R)-3,3-DIPHENYL-1-METHYLTETRAHYDRO-1H,3H-PYRROLO[1,2-C][1,3,2]OXAZABOROLE
  • (R)-TETRAHYDRO-1-METHYL-3,3-DIPHENYL-1H,3H-PYRROLO[1,2-C][1,3,2]OXAZOBOROLE

FAQ

What are the physical and chemical properties of 1-Methyl-3,3-diphenyltetrahydro-3H-pyrrolo[1,2-c][1,3,2]oxazaborole (CAS: 133261-83-3)?

1-Methyl-3,3-diphenyltetrahydro-3H-pyrrolo[1,2-c][1,3,2]oxazaborole is a crystalline solid with a molecular weight of approximately 324.27 g/mol. It has low water solubility and moderate solubility in organic solvents. The compound is known for its chemical stability and reactivity in organic synthesis, particularly in reactions involving boron-containing compounds.

How is 1-Methyl-3,3-diphenyltetrahydro-3H-pyrrolo[1,2-c][1,3,2]oxazaborole (CAS: 133261-83-3) typically synthesized?

1-Methyl-3,3-diphenyltetrahydro-3H-pyrrolo[1,2-c][1,3,2]oxazaborole is commonly synthesized via a multistep process involving the condensation of 1,3-diphenyltetrahydro-3H-pyrrolo[1,2-c][1,3,2]oxazaborole with methyl bromide. The synthesis typically requires the use of catalytic amounts of palladium(II) acetate and triphenylphosphine to achieve good yield and selectivity.

What industries use 1-Methyl-3,3-diphenyltetrahydro-3H-pyrrolo[1,2-c][1,3,2]oxazaborole (CAS: 133261-83-3)?

1-Methyl-3,3-diphenyltetrahydro-3H-pyrrolo[1,2-c][1,3,2]oxazaborole is primarily used in the pharmaceutical industry for developing novel drug candidates. It is also explored in the polymer industry for its potential as a monomer, and in the semiconductor industry for its use in organic electronics and as a dopant.

What precautions should be taken when handling 1-Methyl-3,3-diphenyltetrahydro-3H-pyrrolo[1,2-c][1,3,2]oxazaborole (CAS: 133261-83-3)?

When handling 1-Methyl-3,3-diphenyltetrahydro-3H-pyrrolo[1,2-c][1,3,2]oxazaborole, it is essential to wear appropriate personal protective equipment (PPE) including gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated fume hood to minimize exposure. Spills should be cleaned up using appropriate absorbents, and the material safety data sheet (MSDS) should be consulted for specific disposal instructions and safety measures.

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