Boc-(2S,4S)-4-phenyl-pyrrolidine-2-carboxylic acid

• CAS: 96314-29-3
• Catalog Number: ACM96314293-1
• Category: Amino Acids
• Molecular Weight: 291.3
• Molecular Formula: C16H21NO4
• Description: (2S,4S)-1-(tert-butoxycarbonyl)-4-phenylpyrrolidine-2-carboxylic acido belongs to the class of cyclic dipeptides, which are synthetic or naturally occurring molecules that are formed through the condensation of two amino acids. (2S,4S)-1-(tert-butoxycarbonyl)-4-phenylpyrrolidine-2-carboxylic acido specifically comprises D-phenylalanine and L-proline amino acids, followed by the removal of the amino group to form a pyrrolidine ring. The molecule is often used as a building block in the synthesis of other cyclic dipeptides, due to its unique physicochemical properties.
• Synonyms: (2S,4S)-1-(tert-butoxycarbonyl)-4-phenyl-2-pyrrolidinecarboxylic acid, (2S,4S)-4-phenyl-pyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester, (2S,4S)-Boc-4-phenylpyrrolidine-2-carboxylic acid
• IUPAC Name: (2S,4S)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylpyrrolidine-2-carboxylic acid
• Canonical SMILES: CC(C)(C)OC(=O)N1CC(CC1C(=O)O)C2=CC=CC=C2
• InChI: 1S/C16H21NO4/c1-16(2,3)21-15(20)17-10-12(9-13(17)14(18)19)11-7-5-4-6-8-11/h4-8,12-13H,9-10H2,1-3H3,(H,18,19)/t12-,13+/m1/s1
• InChI Key: JDAQDIQHICLYKH-OLZOCXBDSA-N
• Boiling Point: 441.5ºC at 760 mmHg
• Flash Point: 220.8ºC
• Density: 1.196 g/cm³
• Application: (2S,4S)-1-(tert-butoxycarbonyl)-4-phenylpyrrolidine-2-carboxylic acido has found numerous applications in various fields of research and industry, including drug discovery, peptide synthesis, and materials science. The molecule has been used as a building block in the synthesis of cyclic peptides with improved pharmacological properties, as well as in the development of biomaterials such as hydrogels and nanomaterials.
• Exact Mass: 291.147
• Functional Group: Boc
• LogP: 2.8021
• MDL Number: MFCD01321010
• PSA: 66.84
• Refractive Index: 1.548
• Storage Temperature: 4 ℃
• Type: Unusual Amino Acids, Analogs of Proline