1-(tert-butoxycarbonyl)azetidine-2-carboxylic acid

1-(tert-butoxycarbonyl)azetidine-2-carboxylic acid - Names and Identifiers

Name	Azetidine-1,2-Carboxylic acid 1-tert-butyl ester
Synonyms	BOC-AZETIDINE-2-CARBOXYLIC ACID BOC-Azetidine-2-Carboxylic acid N-Boc-Azetidine-2-carboxylic acid 1-Boc-azetidine-2-carboxylic acid 1-Boc-L-azetidine-2-carboxylic acid 1-N-BOC-AZETIDINE-2-CARBOXYLIC ACID 1-N-BOC-Azetidine-2-Carboxylic acid N-Boc-RS-2-Azetidinecarboxylic acid Azetidine-1,2-Carboxylic acid 1-tert-butyl ester 1-(tert-butoxycarbonyl)azetidine-2-carboxylic acid AZETIDINE-1,2-DICARBOXYLIC ACID 1-TERT-BUTYL ESTER Azetidine-1,2-Dicarboxylic Acid 1-Tert-Butyl Ester AZETIDINE-1,2-DICARBOXYLIC ACID 1-TERT-BUTYL ESTER N-BOC-
CAS	159749-28-7
InChI	InChI=1/C9H15NO4/c1-9(2,3)14-8(13)10-5-4-6(10)7(11)12/h6H,4-5H2,1-3H3,(H,11,12)

1-(tert-butoxycarbonyl)azetidine-2-carboxylic acid - Physico-chemical Properties

Molecular Formula	C9H15NO4
Molar Mass	201.22
Density	1.246±0.06 g/cm3(Predicted)
Boling Point	321.0±35.0 °C(Predicted)
Flash Point	147.9°C
Vapor Presure	6.35E-05mmHg at 25°C
pKa	4.01±0.20(Predicted)
Storage Condition	2-8°C
Refractive Index	1.51
Physical and Chemical Properties	WGK Germany:3

1-(tert-butoxycarbonyl)azetidine-2-carboxylic acid - Risk and Safety

Risk Codes	R36/37/38 - Irritating to eyes, respiratory system and skin. R50 - Very Toxic to aquatic organisms
Safety Description	S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S36 - Wear suitable protective clothing. S61 - Avoid release to the environment. Refer to special instructions / safety data sheets. S24/25 - Avoid contact with skin and eyes.
UN IDs	UN3077
WGK Germany	3
HS Code	29339900

1-(tert-butoxycarbonyl)azetidine-2-carboxylic acid - Introduction

Azetidine-1,2-Carboxylic acid 1-tert-butyl ester is an organic compound, also known as Boc-L-proline. The following is a description of its nature, use, preparation and safety information:

Nature:
-Appearance: Colorless crystalline solid
-molecular formula: C12H21NO4
-Molecular Weight: 247.30
-Melting point: 69-71 ℃
-Boiling point: 400.8 ° C at 760 mmHg
-Flash point: 196 ° C

Use:
- Azetidine-1,2-Carboxylic acid 1-tert-butyl ester is a commonly used amino protecting group, which can protect the amino group after reacting with the amino group.
-In organic synthesis, it is often used as an intermediate for the synthesis of peptides and other organic molecules.

Method:
- Azetidine-1,2-Carboxylic acid 1-tert-butyl ester can be synthesized by the following steps:
1. First, L-Aminobutyric acid is reacted with a L-tert-butoxycarbonylating agent such as t-butyl hydroxymethyl carbonate under basic conditions to produce L-tert-butoxycarbonyl-L-aminobutyric acid.
2. Then, 1-tert-butoxycarbonyl-l-aminobutyric acid and diethyl carbonate (or other appropriate carbonic acid reagent) are subjected to a cycloesterification reaction under alkaline conditions to produce Azetidine-1,2-Carboxylic acid 1-tert-butyl ester.

Safety Information:
- Azetidine-1,2-Carboxylic acid 1-tert-butyl ester should be kept away from high temperature, fire and oxidizing agents, and avoid contact with skin and eyes.
-when in use should wear protective gloves, protective glasses and other personal protective equipment, to avoid direct contact.
-Maintain good ventilation during operation.
-Observe appropriate safety procedures during handling and storage. If accidental inhalation or skin contact occurs, immediately go to the fresh air or rinse with water, and seek medical help.

Last Update：2024-04-10 22:29:15