2-Methyl-2-propanyl 3-(2-bromoethoxy)propanoate

Basic Information

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CAS Number

1393330-36-3

Molecular Formula

C9H17BrO3

Molecular Weight

253.14 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Physical Properties

SMILES

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CC(C)(C)OC(=O)CCOCCBr

InChI

InChI=1S/C9H17BrO3/c1-9(2,3)13-8(11)4-6-12-7-5-10/h4-7H2,1-3H3

InChIKey

KRGOEVTUVNSLIG-UHFFFAOYSA-N

LogP

2.1296999999999997

Topological Polar Surface Area

35.53 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

151

Synonyms & References

English

Bromo-PEG1-t-butyl ester
tert-butyl 3-(2-bromoethoxy)propanoate
Bromo-PEG1-C2-Boc
Bromo-PEG1-t-butylester
Br-PEG1-CH2CH2COOtBu

MDL Number

MFCD22574803

FAQ

What are the physical and chemical properties of 2-Methyl-2-propanyl 3-(2-bromoethoxy)propanoate (CAS: 1393330-36-3)?

2-Methyl-2-propanyl 3-(2-bromoethoxy)propanoate is a colorless to light yellow liquid at room temperature. Its molecular weight is approximately 265.13 g/mol. The compound is moderately soluble in common organic solvents. Chemically, it is reactive towards nucleophiles and can undergo nucleophilic substitution reactions. It also exhibits ester-like properties under certain conditions.

How is 2-Methyl-2-propanyl 3-(2-bromoethoxy)propanoate (CAS: 1393330-36-3) typically synthesized?

2-Methyl-2-propanyl 3-(2-bromoethoxy)propanoate is synthesized through a condensation reaction between 2-bromobutane and 2-methyl-2-propanol. The reaction is typically carried out in the presence of a strong base such as sodium hydride. The yield is around 75%, and the product is obtained with good selectivity.

What industries use 2-Methyl-2-propanyl 3-(2-bromoethoxy)propanoate (CAS: 1393330-36-3)?

2-Methyl-2-propanyl 3-(2-bromoethoxy)propanoate finds applications in the pharmaceutical industry for intermediate synthesis and as a reagent in organic synthesis. It is also used in the polymer industry for functionalization of polymers and in the sensor industry for developing chemical sensors.

What precautions should be taken when handling 2-Methyl-2-propanyl 3-(2-bromoethoxy)propanoate (CAS: 1393330-36-3)?

When handling 2-Methyl-2-propanyl 3-(2-bromoethoxy)propanoate, it is crucial to use appropriate personal protective equipment (PPE) such as gloves, goggles, and lab coat. It should be stored in a cool, dry place, away from heat sources. In case of spill, use a fume hood and appropriate absorbents. Always refer to the Safety Data Sheet (SDS) for specific handling instructions and emergency procedures.