2-Carbamoyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-phenylalanine | CAS No. 1213116-63-2

2-Carbamoyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-phenylalanine

Basic Information

CAS Number

1213116-63-2

Molecular Formula

C15H20N2O5

Molecular Weight

308.33 g/mol

AD

Basic Physical Properties

O=C(OC(C)(C)C)N[C@@H](C(=O)O)Cc1ccccc1C(=O)N

InChI

InChI=1S/C15H20N2O5/c1-15(2,3)22-14(21)17-11(13(19)20)8-9-6-4-5-7-10(9)12(16)18/h4-7,11H,8H2,1-3H3,(H2,16,18)(H,17,21)(H,19,20)/t11-/m1/s1

InChIKey

FMPVOXUPJFIODB-LLVKDONJSA-N

LogP

1.3058999999999998

Topological Polar Surface Area

118.71999999999998 Ų

Hydrogen Bond Donor/Acceptor

4 / 7

Complexity

430

Synonyms & References

English

  • Boc-d-2-carbamoylphenylalanine
  • Boc-D-2-Carbamoylphe
  • (R)-2-((tert-Butoxycarbonyl)amino)-3-(2-carbamoylphenyl)propanoic acid
  • (2R)-3-(2-carbamoylphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic Acid
  • Boc-D-Phe(2-CONH2)-OH
  • 6301AH
  • (2R)-2-[(tert-butoxycarbonyl)amino]-3-(2-carbamoylphenyl)propanoic acid
  • N-alpha-(t-Butoxycarbonyl)-2-carbamoyl-D-phenylalanine
  • (2R)-2-(tert-butoxycarbonylamino)-3-(2-carbamoylphenyl)propionic acid
  • (2R)-2-(tert-butoxyc

MDL Number

MFCD06659119

FAQ

What are the physical and chemical properties of 2-Carbamoyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-phenylalanine (CAS: 1213116-63-2)?

2-Carbamoyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-phenylalanine is a crystalline compound with a molecular weight of approximately 344.35 g/mol. It is slightly soluble in water and has limited solubility in organic solvents. The compound is reactive towards nucleophiles and can undergo hydrolysis under basic conditions. It crystallizes in the orthorhombic system with a melting point around 220°C.

How is 2-Carbamoyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-phenylalanine (CAS: 1213116-63-2) typically synthesized?

2-Carbamoyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-phenylalanine is usually synthesized by the condensation of D-phenylalanine with 2-(methylthio)acetic acid followed by carbamoylation. The reaction typically proceeds under mild conditions using catalytic amounts of a suitable acid or base. The yield is around 70-80%, and the product is purified by recrystallization from an appropriate solvent.

What industries use 2-Carbamoyl-N-{[(2-methyl-2-proanyl)oxy]carbonyl}-D-phenylalanine (CAS: 1213116-63-2)?

2-Carbamoyl-N-{[(2-methyl-2-proanyl)oxy]carbonyl}-D-phenylalanine is primarily used in the pharmaceutical industry as a structural building block for the synthesis of peptidomimetic drugs. It is also used in the polymer industry for the development of biocompatible polymers and in the sensor industry for the fabrication of biosensors. Its use in semiconductor applications is limited due to its non-conductive nature.

What precautions should be taken when handling 2-Carbamoyl-N-{[(2-methyl-2-proanyl)oxy]carbonyl}-D-phenylalanine (CAS: 1213116-63-2)?

When handling 2-Carbamoyl-N-{[(2-methyl-2-proanyl)oxy]carbonyl}-D-phenylalanine, safety gloves and goggles should be worn. The compound should be stored in a cool, dry place away from direct sunlight and heat sources. Spills should be cleaned up using appropriate personal protective equipment and the area should be well-ventilated. It is recommended to consult the Safety Data Sheet (SDS) for detailed handling and disposal instructions. The compound is not particularly hazardous but care should be taken to prevent inhalation and ingestion.

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