Methyl (R)-3-acetamido-3-phenylpropanoate

Base Information

• Chemical Name: Methyl (R)-3-acetamido-3-phenylpropanoate
• CAS No.: 67654-57-3
• Molecular Formula: C12H15NO3
• Molecular Weight: 221.256
• Mol file: 67654-57-3.mol

Synonyms:(R)-methyl-3-acetamido-3-phenylpropanoate; methyl (S)-3-acetylamino-3-phenylpropionate; (-)-S-methyl 3-amino-3-phenylpropanoate acetamide; 3-acetylamino-(R)-3-phenylpropionic acid methyl ester; methyl (S)-3-acetamido-3-phenylpropanoate; (S)-methyl 3-acetamido-3-phenyl-propanoate; methyl 3-acetylamino-3-phenylpropanoate; 查看更多英文别名 收起

Chemical Property of Methyl (R)-3-acetamido-3-phenylpropanoate

Chemical Property:

• Vapor Pressure: 8.36E-07mmHg at 25°C
• Melting Point: 94-95 °C
• Refractive Index: 1.513
• Boiling Point: 406.1 °C at 760 mmHg
• PKA: 14.78±0.46(Predicted)
• Flash Point: 199.4 °C
• PSA: 55.40000
• Density: 1.114 g/cm³
• LogP: 1.81780

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Methyl (R)-3-acetamido-3-phenylpropanoate

There total 51 articles about Methyl (R)-3-acetamido-3-phenylpropanoate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 100.0%

methyl (Z)-3-acetylamino-3-phenylacrylate (72569-96-1,136744-88-2,67654-55-1) → methyl (R)-3-acetamido-3-phenylpropanoate (67654-57-3)

Guidance literature:

With BF₄^(1-)*C₂₇H₄₂O₂P₂Rh⁽¹⁺⁾; hydrogen; In methanol; at 20 ℃; for 12h; under 5171.62 Torr; optical yield given as %ee; enantioselective reaction; Inert atmosphere; Autoclave;

DOI:10.1021/ol1000999

Reference yield: 100.0%

(E/Z)-methyl 3-acetamido-3-phenyl-2-propenoate → methyl (S)-3-acetylamino-3-phenylpropionate (67654-57-3,105900-59-2,67654-58-4)

Guidance literature:

With bis(1,5-cyclooctadiene)rhodium(I) tetrafluoroborate; hydrogen; C₄₇H₄₃FeNOP₂; In toluene; for 12h; Inert atmosphere;

Reference yield: 97.0%

(E/Z)-methyl 3-acetamido-3-phenyl-2-propenoate → methyl (R)-3-acetamido-3-phenylpropanoate (67654-57-3)

Guidance literature:

With (S)-binapine; hydrogen; nickel diacetate; In 2,2,2-trifluoroethanol; at 50 ℃; for 24h; under 38002.6 Torr; enantioselective reaction; Glovebox;

DOI:10.1021/acs.orglett.7b02417

upstream raw materials:

(E)-methyl 3-acetamido-3-phenyl-2-propenoate

methyl (Z)-3-acetylamino-3-phenylacrylate

2,2,2-trifluoroethylbutyrate

methyl 3-acetamido-3-phenylpropanoate

Downstream raw materials:

(R)-3-ethylamino-3-phenyl-1-propanol

(R)-3-phenyl-3-aminopropionic acid

(R)-3-amino-3-phenyl-1-propanol

methyl (2S,3S)-3-(acetylamino)-2-fluoro-3-phenylpropanoate