CID 6992570

Base Information

• Chemical Name: CID 6992570
• CAS No.: 13726-76-6
• Molecular Formula: C11H22N4O4
• Molecular Weight: 274.32
• Hs Code.: 29252900
• Mol file: 13726-76-6.mol

Synonyms:

Chemical Property of CID 6992570

Chemical Property:

• Melting Point: 117-119°C
• Refractive Index: 1.54
• PKA: 3.92±0.21(Predicted)
• Flash Point: >230°F
• PSA: 137.53000
• Density: 1.283 g/cm³
• LogP: 1.80940
• Storage Temp.: Store at 0°C
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 274.16410520
• Heavy Atom Count: 19
• Complexity: 340

Purity/Quality:

99% ^*data from raw suppliers

N-alpha-Boc-L-arginine ^*data from reagent suppliers

Safty Information:

• Safety Statements: 22-24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)NC(CCC[NH+]=C(N)N)C(=O)[O-]
• Isomeric SMILES: CC(C)(C)OC(=O)N[C@@H](CCC[NH+]=C(N)N)C(=O)[O-]
• Uses: Boc-Arg-OH is a nucleic acid carrier and a peptide that functions in the delivery systems of genes.

Technology Process of CID 6992570

There total 9 articles about CID 6992570 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: 92.0%

di-tert-butyl dicarbonate (24424-99-5) + L-arginine hydrochloride (1119-34-2) → t-butyloxycarbonyl-L-arginine (13726-76-6,78603-12-0)

Guidance literature:

With sodium hydroxide; In 1,4-dioxane; at 20 ℃; for 21h;

DOI:10.1007/s11164-017-3199-6

Reference yield: 90.0%

L-arginine (74-79-3,25212-18-4) + di-tert-butyl dicarbonate (24424-99-5) → t-butyloxycarbonyl-L-arginine (13726-76-6,78603-12-0)

Guidance literature:

With sodium hydroxide; In 1,4-dioxane; water; at 20 ℃; for 12h;

DOI:10.1039/d1ob00798j

Reference yield: 79.0%

2-tert-butoxycarbonylamino-5-guanidino-pentanoic acid tert-butyl ester → t-butyloxycarbonyl-L-arginine (13726-76-6,78603-12-0)

Guidance literature:

With cerium(III) chloride; sodium iodide; In acetonitrile; for 2h; Heating;

DOI:10.1021/jo010010y

upstream raw materials:

N-(tert-butyloxycarbonyl) azide

L-arginine

tert-butyl chloroformate

di-tert-butyl oxalate

Downstream raw materials:

2TFA*H-Arg-Leu-Phe-S-(3-nitro-2-pyridinesulfenyl)-NH₂

[2-(2-{2-[2-((S)-2-tert-Butoxycarbonylamino-5-guanidino-pentanoylamino)-5-phenoxymethyl-benzoylamino]-acetylamino}-acetylamino)-acetylamino]-acetic acid ethyl ester

Neuropeptide C

protease-activated receptor-1 agonist peptide