Boc-Lys(Z)-Lys(Z)-OMe

Base Information

• Chemical Name: Boc-Lys(Z)-Lys(Z)-OMe
• CAS No.: 27317-68-6
• Molecular Formula: C34H48 N4 O9
• Molecular Weight: 656.777
• Nikkaji Number: J1.929.427G
• Mol file: 27317-68-6.mol

Synonyms:Boc-Lys(Z)-Lys(Z)-OMe;SCHEMBL7323841;ZDAZTOCQAWNOCZ-NSOVKSMOSA-N

Chemical Property of Boc-Lys(Z)-Lys(Z)-OMe

Chemical Property:

• Vapor Pressure: 4.57E-28mmHg at 25°C
• Boiling Point: 835°Cat760mmHg
• Flash Point: 458.8°C
• Density: 1.172g/cm³
• XLogP3: 4.8
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 23
• Exact Mass: 656.34212912
• Heavy Atom Count: 47
• Complexity: 960

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)NC(CCCCNC(=O)OCC1=CC=CC=C1)C(=O)NC(CCCCNC(=O)OCC2=CC=CC=C2)C(=O)OC
• Isomeric SMILES: CC(C)(C)OC(=O)N[C@@H](CCCCNC(=O)OCC1=CC=CC=C1)C(=O)N[C@@H](CCCCNC(=O)OCC2=CC=CC=C2)C(=O)OC

Technology Process of Boc-Lys(Z)-Lys(Z)-OMe

There total 10 articles about Boc-Lys(Z)-Lys(Z)-OMe 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: 96.0%

Boc-Lys(Z)-OSu (34404-36-9) + methyl (2S)-2-amino-6-{[(benzyloxy)carbonyl]amino}hexanoate hydrochloride (27894-50-4) → Boc-Lys(Z)-Lys(Z)-OMe (27317-68-6)

Guidance literature:

With N-ethyl-N,N-diisopropylamine; In dichloromethane; N,N-dimethyl-formamide; at -15 - 20 ℃; for 12.5h; Inert atmosphere;

DOI:10.1002/pola.26208

Reference yield: 94.0%

Boc-Lys(Z)-OPcp (17693-16-2) + methyl (2S)-2-amino-6-{[(benzyloxy)carbonyl]amino}hexanoate hydrochloride (27894-50-4) → Boc-Lys(Z)-Lys(Z)-OMe (27317-68-6)

Guidance literature:

With 1-hydroxybenzotriazol-hydrate; N-ethyl-N,N-diisopropylamine; In N,N-dimethyl-formamide; for 0.5h; Ambient temperature;

Reference yield: 88.0%

Boc-Lys(Z)-OH (2389-45-9) + methyl (2S)-2-amino-6-{[(benzyloxy)carbonyl]amino}hexanoate hydrochloride (27894-50-4) → Boc-Lys(Z)-Lys(Z)-OMe (27317-68-6)

Guidance literature:

With diphenylphosphoranyl azide; triethylamine; In N,N-dimethyl-formamide; at 0 - 20 ℃;

DOI:10.1021/jm00373a014

upstream raw materials:

Boc-Lys(Z)-OSu

methyl (2S)-2-amino-6-{[(benzyloxy)carbonyl]amino}hexanoate hydrochloride

Boc-Lys(Z)-OH

Boc-Lys(Z)-OPcp

Downstream raw materials:

N^ε,N^ε-bis(benzyloxycarbonyl)-L-lysyl-L-lysine methyl ester trifluoroacetate

C₆₇H₈₅N₉O₁₇

α-BOC-tetra-ε-Z-lys₄OH

C₆₂H₈₄N₈O₁₅