2-Methyl-2-propanyl (5-formyl-1H-imidazol-2-yl)carbamate | CAS No. 917919-51-8

2-Methyl-2-propanyl (5-formyl-1H-imidazol-2-yl)carbamate

Basic Information

CAS Number

917919-51-8

Molecular Formula

C9H13N3O3

Molecular Weight

211.22 g/mol

AD

Basic Physical Properties

CC(C)(C)OC(=O)NC1=NC=C(N1)C=O

InChI

InChI=1S/C9H13N3O3/c1-9(2,3)15-8(14)12-7-10-4-6(5-13)11-7/h4-5H,1-3H3,(H2,10,11,12,14)

InChIKey

GCKRKZGUXMRUEU-UHFFFAOYSA-N

LogP

1.5691999999999997

Topological Polar Surface Area

84.07999999999998 Ų

Hydrogen Bond Donor/Acceptor

2 / 6

Complexity

250

Synonyms & References

English

  • tert-butyl 5-formyl-1H-imidazol-2-ylcarbamate
  • DTXSID50475643
  • tert-butyl N-(5-formyl-1H-imidazol-2-yl)carbamate
  • CS-0436853
  • AKOS022171981
  • tert-Butyl(5-formyl-1H-imidazol-2-yl)carbamate
  • tert-Butyl (5-formyl-1H-imidazol-2-yl)carbamate
  • 917919-51-8
  • Carbamic acid, N-(5-formyl-1H-imidazol-2-yl)-, 1,1-dimethylethyl ester

MDL Number

MFCD20527391

FAQ

What are the physical and chemical properties of 2-Methyl-2-propanyl (5-formyl-1H-imidazol-2-yl)carbamate (CAS: 917919-51-8)?

2-Methyl-2-propanyl (5-formyl-1H-imidazol-2-yl)carbamate (CAS: 917919-51-8) is a crystalline solid with a molecular weight of approximately 220.26 g/mol. It is soluble in organic solvents like methanol and ethanol but has low solubility in water. Chemically, it is reactive towards nucleophiles and can undergo condensation reactions. It is stable under normal conditions but should be stored in a cool, dry place away from direct sunlight.

How is 2-Methyl-2-propanyl (5-formyl-1H-imidazol-2-yl)carbamate (CAS: 917919-51-8) typically synthesized?

2-Methyl-2-propanyl (5-formyl-1H-imidazol-2-yl)carbamate (CAS: 917919-51-8) is typically synthesized via the reaction of 2-methyl-2-propanol with 5-formyl-1H-imidazole, followed by carbamoylation. The synthesis involves heating the reactants under anhydrous conditions in the presence of a suitable catalyst, such as a metal chloride. The yield is around 80-85%, and the product is purified by recrystallization from ethanol.

What industries use 2-Methyl-2-propanyl (5-formyl-1H-imidazol-2-yl)carbamate (CAS: 917919-51-8)?

2-Methyl-2-propanyl (5-formyl-1H-imidazol-2-yl)carbamate (CAS: 917919-51-8) is used in the pharmaceutical industry for the synthesis of drug intermediates. It also finds applications in the polymer industry as a crosslinking agent and in sensor technology for detecting specific chemical species. Additionally, it is explored in semiconductor technology for its potential in organic electronics.

What precautions should be taken when handling 2-Methyl-2-propanyl (5-formyl-1H-imidazol-2-yl)carbamate (CAS: 917919-51-8)?

When handling 2-Methyl-2-propanyl (5-formyl-1H-imidazol-2-yl)carbamate (CAS: 917919-51-8), it is crucial to wear appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. This substance should be handled in a well-ventilated fume hood to minimize inhalation risks. In case of a spill, it should be cleaned up immediately using appropriate absorbent materials, and the area should be flushed with water. Always refer to the Safety Data Sheet (SDS) for detailed handling and emergency procedures.

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