3-Bromomethyl-1,2-benzisoxazole

3-Bromomethyl-1,2-benzisoxazole - Names and Identifiers

Name	3-Bromomethyl-1,2-benzisoxazole
Synonyms	BMBI 3-Bromomethylbenzisoxazole 3-Bromoethylbenzo[o]isoxazole 3-(bromomethyl)-1,2-benzoxazole 3-Bromomethyl-1,2-benzisoxazole 3-Bromomethyl-benzo[d]isoxazole 3-(bromomethyl)benzo[d]isoxazole 3-(Bromomethyl)Benzo[D]Isoxazole 3-(BROMOMETHYL)-1,2-BENZISOXAZOLE 1,2-Benzisoxazole, 3-(bromomethyl)- 3-BROMOMETHYL-1,2-BENZISOXAZOLE(ZONISAMIDE INTERMEDIATE)
CAS	37924-85-9
InChI	InChI=1/C8H6BrNO/c9-5-7-6-3-1-2-4-8(6)11-10-7/h1-4H,5H2

3-Bromomethyl-1,2-benzisoxazole - Physico-chemical Properties

Molecular Formula	C8H6BrNO
Molar Mass	212.04
Density	1.642±0.06 g/cm3(Predicted)
Melting Point	64-65°C
Boling Point	302.5±17.0 °C(Predicted)
Flash Point	136.8°C
Solubility	Acetone, Chloroform, Dichloromethane, Ethyl Acetate
Vapor Presure	0.00176mmHg at 25°C
Appearance	Solid
Color	Colourless Crystalline
pKa	-3.26±0.30(Predicted)
Storage Condition	under inert gas (nitrogen or Argon) at 2-8°C
Refractive Index	1.651

3-Bromomethyl-1,2-benzisoxazole - Risk and Safety

Hazard Symbols	Xn - Harmful
Risk Codes	R22 - Harmful if swallowed R36 - Irritating to the eyes
Safety Description	26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
HS Code	29349990

3-Bromomethyl-1,2-benzisoxazole - Introduction

3-Bromomethyl-1,2-benzisoxazole is an organic compound whose chemical formula is C8H6BrNO. The following is a description of its nature, use, formulation and safety information:

Nature:
-Appearance: 3-Bromomethyl-1,2-benzisoxazole is a white to pale yellow solid.
-Melting point: Its melting point is about 75-77 degrees Celsius.
-Solubility: It has a certain solubility in common organic solvents.

Use:
-Chemical synthesis: 3-Bromomethyl-1,2-benzisoxazole can be used as an intermediate for the synthesis of other organic compounds. It can be used in organic synthesis for acylation, alkylation, carbonylation and other reactions.
-Drug research: The compound also has applications in the field of drug research and can be used to synthesize biologically active compounds.

Preparation Method:
The preparation method of 3-Bromomethyl-1,2-benzisoxazole is mainly divided into two steps:
1. First, 1,2-benzisoxazole is reacted with 2,3-dibromopropane to generate 3-Bromomethyl-1,2-benzisoxazole.
2. Then, through process steps such as rectification and crystallization purification, 3-Bromomethyl-1,2-benzisoxazole with higher purity is obtained.

Safety Information:
- 3-Bromomethyl-1,2-benzisoxazole should be used and stored to avoid contact with strong oxidants and strong acids to avoid possible dangerous reactions.
-Appropriate engineering controls and protective equipment, such as wearing protective gloves, goggles and protective clothing, should be used during operation.
-Please refer to the safety data form of the substance for more detailed and accurate safety information at the time of use.

Please note that when using and handling organic compounds, you should always follow correct safe operating procedures and consult professional advice when needed.

Last Update：2024-04-09 21:01:54