N~2~-(tert-butoxycarbonyl)-N~6~-formyllysine

Base Information

• Chemical Name: N~2~-(tert-butoxycarbonyl)-N~6~-formyllysine
• CAS No.: 2483-47-8
• Molecular Formula: C12H22 N2 O5
• Molecular Weight: 274.317
• Hs Code.: 2924199090
• NSC Number: 334077
• ChEMBL ID: CHEMBL1450988
• Mol file: 2483-47-8.mol

Synonyms:N~2~-(tert-butoxycarbonyl)-N~6~-formyllysine;102616-34-2;6-formamido-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoic acid;(2S)-6-formamido-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoic acid;N2-(tert-butoxycarbonyl)-N6-formyllysine;NSC334077;Tridecamethylene glycol;CBDivE_003195;MLS000058755;CHEMBL1450988;SCHEMBL23157236;2-{[(tert-butoxy)carbonyl]amino}-6-formamidohexanoic acid;HMS2413H17;EINECS 219-619-4;STK013824;AKOS000491735;AKOS016352350;NSC 334077;NSC-334077;SMR000069021;CS-0335632;FT-0770660;A877786;AN-329/05072040

Chemical Property of N~2~-(tert-butoxycarbonyl)-N~6~-formyllysine

Chemical Property:

• Vapor Pressure: 2.97E-12mmHg at 25°C
• Melting Point: 125-128 °C
• Boiling Point: 521 °C at 760 mmHg
• PKA: 3.98±0.21(Predicted)
• Flash Point: 268.9 °C
• PSA: 104.73000
• Density: 1.142 g/cm³
• LogP: 2.29830
• Storage Temp.: −20°C
• XLogP3: 1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 9
• Exact Mass: 274.15287181
• Heavy Atom Count: 19
• Complexity: 312

Purity/Quality:

98% ^*data from raw suppliers

Na-Boc-Ne-formyl-L-lysine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)NC(CCCCNC=O)C(=O)O

Technology Process of N~2~-(tert-butoxycarbonyl)-N~6~-formyllysine

There total 3 articles about N~2~-(tert-butoxycarbonyl)-N~6~-formyllysine 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:

N-(tert-butyloxycarbonyl) azide (1070-19-5) + Nε-formyl-(2S)-lysine (1190-48-3) → Nα-Boc-Nε-formyl-L-lysine (2483-47-8,102616-34-2)

Guidance literature:

With triethylamine;

DOI:10.1021/ja01081a039

Reference yield:

formic acid (64-18-6) + Boc-Lys-OH (13734-28-6) → Nα-Boc-Nε-formyl-L-lysine (2483-47-8,102616-34-2)

Guidance literature:

at 37 ℃; for 168h; pH=7.4; aq. phosphate buffer;

DOI:10.1021/jf100334r

Reference yield:

Boc-Lys-OH (13734-28-6) + 1-deoxy-2,3-D-erythro-hexo-2,3-diulose → formic acid (64-18-6) + L-Lactic acid (79-33-4,106989-11-1,26811-96-1,31587-11-8,26100-51-6) + D-glyceric acid (473-81-4,600-19-1,6000-40-4,28305-26-2,118916-26-0) + (S)-6-acetamido-2-((tertbutoxycarbonyl)amino)hexanoic acid (6404-26-8) + C14H26N2O6 + C14H26N2O7 + acetic acid (64-19-7,77671-22-8) + Nα-Boc-Nε-formyl-L-lysine (2483-47-8,102616-34-2)

Guidance literature:

With air; at 37 ℃; for 168h; pH=7.4; aq. phosphate buffer;

DOI:10.1021/jf100334r

upstream raw materials:

N-(tert-butyloxycarbonyl) azide

N^ε-formyl-(2S)-lysine

formic acid

Boc-Lys-OH

Downstream raw materials:

N^ε-formyl-(2S)-lysine

Boc-Leu-Aib-Lys(F)-Aib-Aib-Lys(F)-Aib-OBzl

2-{(S)-2-[2-(2-{(S)-2-[2-((S)-2-Amino-4-methyl-pentanoylamino)-2-methyl-propionylamino]-6-formylamino-hexanoylamino}-2-methyl-propionylamino)-2-methyl-propionylamino]-6-formylamino-hexanoylamino}-2-methyl-propionic acid benzyl ester

Refernces