(2S,3S)-2-amino-3-methylpentanamide hydrochloride

Base Information

• Chemical Name: (2S,3S)-2-amino-3-methylpentanamide hydrochloride
• CAS No.: 10466-56-5
• Molecular Formula: C6H15ClN2O
• Molecular Weight: 166.651
• Hs Code.: 2924199090
• European Community (EC) Number: 840-273-0
• ChEMBL ID: CHEMBL1222058
• DSSTox Substance ID: DTXSID40585189
• Mol file: 10466-56-5.mol

Synonyms:10466-56-5;L-Isoleucinamide hydrochloride;H-Ile-NH2.HCl;(2S,3S)-2-amino-3-methylpentanamide hydrochloride;L-Isoleucinamide HCl;(2S,3S)-2-amino-3-methylpentanamide;hydrochloride;H-Ile-NH HCl;MFCD00058476;L-Isoleucine amide hydrochloride;Pentanamide, 2-amino-3-methyl-, monohydrochloride, (2S,3S)-;SCHEMBL738528;CHEMBL1222058;DTXSID40585189;L-(+)-isoleucinamide hydrochloride;AKOS015950973;CS-W017735;FD21807;DS-13817;(2S,3S)-2-Amino-3-methylpentanamide HCl;L-Isoleucinamide--hydrogen chloride (1/1);I0731;EN300-81730;(2S,3S)-2-amino-3-methylpentanamide, hydrochloride;(2S,3S)-2-amino-3-methylvaleric acid amide hydrochloride

Chemical Property of (2S,3S)-2-amino-3-methylpentanamide hydrochloride

Chemical Property:

• Vapor Pressure: 0.00199mmHg at 25°C
• Melting Point: 232-234 °C (decomp)(Solv: acetic acid (64-19-7))
• Refractive Index: 22 ° (C=1, H2O)
• Boiling Point: 286.6 °C at 760 mmHg
• Flash Point: 127.2 °C
• PSA: 69.11000
• LogP: 2.04770
• Storage Temp.: Store at RT.
• Water Solubility.: Soluble in water
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 166.0872908
• Heavy Atom Count: 10
• Complexity: 103

Purity/Quality:

98%,99%, ^*data from raw suppliers

L-Isoleucine amide hydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C)C(C(=O)N)N.Cl
• Isomeric SMILES: CC[C@H](C)[C@@H](C(=O)N)N.Cl
• Uses: L-Isoleucinamide HCl

Technology Process of (2S,3S)-2-amino-3-methylpentanamide hydrochloride

There total 1 articles about (2S,3S)-2-amino-3-methylpentanamide hydrochloride 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: 95.0%

L-isoleucine hydrochloride (17694-98-3) → L-isoleucine amide hydrochloride (10466-56-5)

Guidance literature:

With hexamethylphosphorous triamide dichloride; ammonia; In dichloromethane; 1) 30 min, -20 deg C, 2) 4 h, r.t.;

Reference yield: 95.0%

L-isoleucine amide hydrochloride (10466-56-5) + N,N'-disuccinimidyl-2,2'-dithiosalicylate (497262-13-2) → C26H34N4O4S2 (712350-75-9)

Guidance literature:

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

DOI:10.1016/S0968-0896(01)00392-3

Reference yield: 95.0%

N-tert-butoxycarbonyl-L-phenylalanine (13734-34-4) + L-isoleucine amide hydrochloride (10466-56-5) → [(S)-1-((1S,2S)-1-Carbamoyl-2-methyl-butylcarbamoyl)-2-phenyl-ethyl]-carbamic acid tert-butyl ester

Guidance literature:

With borate buffer; pronase EC 3.4.24.4; triethylamine; In acetonitrile; for 4h; Ambient temperature;

upstream raw materials:

L-isoleucine hydrochloride

Downstream raw materials:

tert-butyl ((2S,3S)-1-amino-3-methyl-1-oxopentan-2-yl)carbamate

Z-Leu-Ile-NH₂

Refernces