2-Methyl-2-propanyl (2-bromoethyl)carbamate

Basic Information

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CAS Number

39684-80-5

Molecular Formula

C7H14BrNO2

Molecular Weight

224.1 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Physical Properties

Melting Point

30-32 °C

Boiling Point

262.2℃ at 760 mmHg

Density

1.321 g/cm3

Flash Point

112.4 °C

Solubility

Soluble in Chloroform, Dichloromethane and Ethyl Acetate.

Refractive Index

1.473

SMILES

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CC(C)(C)OC(=O)NCCBr

InChI

InChI=1S/C7H14BrNO2/c1-7(2,3)11-6(10)9-5-4-8/h4-5H2,1-3H3,(H,9,10)

InChIKey

TZRQZPMQUXEZMC-UHFFFAOYSA-N

LogP

1.906

Topological Polar Surface Area

38.33 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

131

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class IRRITANT Class IRRITANT

Sensitiveness

Sensitive to heat and moisture

Synonyms & References

English

1,1-dimethylethyl (2-bromoethyl)carbamate
tert-Butyl N-(2-bromoethyl)carbamate
n-boc-bromoethylamine
n-t-boc-2-bromethanamine
2-(Boc-amino)ethyl bromide, >=97.0% (GC)
2-(tert-butoxycarbonylamino)-ethyl bromide
2-bromo-1-[(tert-butoxycarbonyl)amino]ethane
tert-butyl (2-bromo-ethyl)carbamate
N-t-Boc-2-bromoethylamine (Technical grade, ~90%)
EN300-64250
n-t-boc-2-bromoethanamine
2-(Boc-amino)-ethylbromide
FT-0629322
boc-2-aminoethylbromide
A6627
N-(tert.-butoxycarbonyl)-2-bromoethylamine
N-t-butoxycarbonyl-2-bromoethylamine
(2-bromo-ethyl)-carbamic acid tert-butyl ester
n-(t-boc)-2-bromoethylamine
2-(t-butoxycarbonylamino)ethyl bromide
N-(tert-butoxycarbonyl)-2-bromoethylamine
(2-Bromo-ethyl)carbamic acid tert-butyl ester
BP-21166
AM20100045
CS-W007731
(N-Boc)-2-aminoethylbromide
2-tert-butoxycarbonylaminoethylbromide
tert-butyl-2-bromoethylcarbamate
Br(CH2)2NHBoc
N-Boc-2-bromoethylamine
tert-butyl 2-bromoethylcarbamate

MDL Number

MFCD02683428

Customs Code

2924199090

FAQ

What are the physical and chemical properties of 2-Methyl-2-propanyl (2-bromoethyl)carbamate (CAS: 39684-80-5)?

2-Methyl-2-propanyl (2-bromoethyl)carbamate is a colorless liquid with a molecular weight of approximately 215.03 g/mol. It has a high boiling point of around 120°C and a low solubility in water. This compound is reactive towards nucleophiles and can undergo nucleophilic substitution reactions. It is commonly used in organic synthesis and as a reactant in various chemical processes.

How is 2-Methyl-2-propanyl (2-bromoethyl)carbamate (CAS: 39684-80-5) typically synthesized?

2-Methyl-2-propanyl (2-bromoethyl)carbamate is typically synthesized through the reaction of 2-bromopropanol with methyl isocyanate in the presence of a suitable base such as potassium carbonate. The process involves mild heating and stirring to achieve a high yield of the desired product. This method is both efficient and selective.

What industries use 2-Methyl-2-propanyl (2-bromoethyl)carbamate (CAS: 39684-80-5)?

2-Methyl-2-propanyl (2-bromoethyl)carbamate is primarily utilized in the pharmaceutical and fine chemical industries for the synthesis of various organic compounds. It is also used in the polymer industry for the modification of polymers and in the electronics sector for the development of sensor materials and semiconductor applications.

What precautions should be taken when handling 2-Methyl-2-propanyl (2-bromoethyl)carbamate (CAS: 39684-80-5)?

When handling 2-Methyl-2-propanyl (2-bromoethyl)carbamate, it is crucial to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood to avoid inhalation of vapors. Spills should be cleaned up immediately using appropriate absorbent materials, and the area should be properly ventilated. Always refer to the Material Safety Data Sheet (MSDS) for detailed safety information and emergency procedures.