Benzyl 3-(4-hydroxyphenyl)-2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]propanoate

Base Information

• Chemical Name: Benzyl 3-(4-hydroxyphenyl)-2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]propanoate
• CAS No.: 57294-46-9
• Molecular Formula: C26H26 N2 O6
• Molecular Weight: 462.502
• European Community (EC) Number: 667-964-8
• NSC Number: 169126
• DSSTox Substance ID: DTXSID00305103
• Mol file: 57294-46-9.mol

Synonyms:57294-46-9;benzyl 3-(4-hydroxyphenyl)-2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]propanoate;NSC169126;CARBOBENZYLOXYGLYCYL-L-TYROSINE BENZYL ESTER;DTXSID00305103;AKOS024432432;NSC-169126

Chemical Property of Benzyl 3-(4-hydroxyphenyl)-2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]propanoate

Chemical Property:

• Vapor Pressure: 2.33E-21mmHg at 25°C
• Boiling Point: 718.9°Cat760mmHg
• Flash Point: 388.6°C
• PSA: 113.96000
• Density: 1.273g/cm³
• LogP: 3.87110
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 12
• Exact Mass: 462.17908655
• Heavy Atom Count: 34
• Complexity: 637

Purity/Quality:

99% ^*data from raw suppliers

CARBOBENZYLOXYGLYCYL-L-TYROSINE BENZYL ESTER Aldrich ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COC(=O)C(CC2=CC=C(C=C2)O)NC(=O)CNC(=O)OCC3=CC=CC=C3

Technology Process of Benzyl 3-(4-hydroxyphenyl)-2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]propanoate

There total 2 articles about Benzyl 3-(4-hydroxyphenyl)-2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]propanoate 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:

L-tyrosine benzyl ester (42406-77-9) + N-(Benzyloxycarbonyl)glycine (1138-80-3) → N-(N-benzyloxycarbonyl-glycyl)-L-tyrosine benzyl ester (57294-46-9)

Guidance literature:

With tetrachloromethane; triethylamine; triphenylphosphine; In acetonitrile;

Reference yield:

→ N-(N-benzyloxycarbonyl-glycyl)-L-tyrosine benzyl ester (57294-46-9)

Guidance literature:

/BRN= 3189835/;

Reference yield:

N-(N-benzyloxycarbonyl-glycyl)-L-tyrosine benzyl ester (57294-46-9) → N-Gly-Tyr (658-79-7)

Guidance literature:

With methanol; palladium; acetic acid; Hydrogenolyse;

upstream raw materials:

L-tyrosine benzyl ester

N-(Benzyloxycarbonyl)glycine

Downstream raw materials:

N-Gly-Tyr