Methyl 2,6-diaminohexanoate

Base Information

• Chemical Name: Methyl 2,6-diaminohexanoate
• CAS No.: 687-64-9
• Molecular Formula: C7H16 N2 O2
• Molecular Weight: 160.216
• Hs Code.: 2922499990
• DSSTox Substance ID: DTXSID60988395
• Nikkaji Number: J1.341.891H
• Mol file: 687-64-9.mol

Synonyms:Methyl DL-lysinate;H-Lys-OMe;methyl 2,6-diaminohexanoate;44977-95-9;NCIOpen2_004669;SCHEMBL541484;DTXSID60988395;AKOS006229278;2,6-diamino-hexanoic acid methyl ester;NCGC00246348-01;EN300-317900;AB00698451-06

Chemical Property of Methyl 2,6-diaminohexanoate

Chemical Property:

• PSA: 78.34000
• LogP: 1.01630
• XLogP3: -0.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 160.121177757
• Heavy Atom Count: 11
• Complexity: 117

Purity/Quality:

98%Min ^*data from raw suppliers

Methyllysinate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C(CCCCN)N

Technology Process of Methyl 2,6-diaminohexanoate

There total 19 articles about Methyl 2,6-diaminohexanoate 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: 98.0%

(+)-(S)-N2,N6-bis[(1,1-dimethylethoxy)carbonyl]-lysine methyl ester (2483-48-9) → L-lysine methyl ester (687-64-9)

Guidance literature:

With trifluoroacetic acid;

DOI:10.1016/j.cclet.2013.06.015

Reference yield: 97.0%

L-Lysine hydrochloride (657-27-2,10098-89-2,26124-78-7) → L-lysine methyl ester (687-64-9)

Guidance literature:

With Amblerite IRA-400 resin; In methanol; for 0.5h;

DOI:10.3390/molecules21010016

Reference yield: 95.8%

methanol (67-56-1) + L-lysine (56-87-1,3506-25-0) → L-lysine methyl ester (687-64-9)

Guidance literature:

With sulfur trioxide; at 20 ℃;

upstream raw materials:

methanol

Lysin-dihydrochlorid

2,6-diaminocaproic acid

L-lysine

Downstream raw materials:

N,N'-di(trifluoroacetyl)-L-lysine methyl ester

(S)-2,6-bis-(2,4-dinitro-anilino)-hexanol

L-Lysin-hydroxamsaeure

D-Lysin-hydroxamsaeure

Refernces

• 1、 -. "Anti-proliferative scar external pharmaceutical preparation". Paragraph 0046-0050; 0054-0055. . Retrieved 2021/06/12.
• 2、 -. "Preparation method of amino-acid ester". Paragraph 0010. . Retrieved 2019/03/15.