3-Amino-4-phenylbutanoic acid hydrochloride

Base Information

• Chemical Name: 3-Amino-4-phenylbutanoic acid hydrochloride
• CAS No.: 460039-42-3
• Molecular Formula: C₁₀H₁₃NO₂*ClH
• Molecular Weight: 215.68
• European Community (EC) Number: 819-152-1
• NSC Number: 127018

Synonyms:3-amino-4-phenylbutanoic acid hydrochloride;460039-42-3;3-Amino-4-phenylbutyric acid hydrochloride;3-amino-4-phenylbutanoic acid;hydrochloride;D-beta-homophenylalanine-HCl;MFCD01862875;MFCD04117838;H-D-beta-HoPhe-OH.HCl;SCHEMBL654577;NSC127018;AKOS022182782;NSC-127018;3-amino-4-phenylbutanoicacidhydrochloride;SY065308;SY110088;CS-0217990;FT-0643280;FT-0643374;(R)-3-Amino-4-phenylbutyricacidhydrochloride;EN300-96575;Z1318516262

Chemical Property of 3-Amino-4-phenylbutanoic acid hydrochloride

Chemical Property:

• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 215.0713064
• Heavy Atom Count: 14
• Complexity: 164

Purity/Quality:

99% ^*data from raw suppliers

3-amino-4-phenylbutanoicAcidhydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CC(CC(=O)O)N.Cl

Technology Process of 3-Amino-4-phenylbutanoic acid hydrochloride

There total 2 articles about 3-Amino-4-phenylbutanoic acid 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:

(S)-3-amino-4-phenylbutanoic acid (820223-86-7) → (S)-3-amino-4-phenylbutanoic acid hydrochloride (138165-77-2,460039-42-3)

Guidance literature:

With hydrogenchloride; water; for 7h; optical yield given as %ee; Reflux;

DOI:10.1039/b920731g

Reference yield:

→ (S)-3-amino-4-phenylbutanoic acid hydrochloride (138165-77-2,460039-42-3)

Guidance literature:

Reference yield:

(S)-3-amino-4-phenylbutanoic acid hydrochloride (138165-77-2,460039-42-3) → N-(3α-hydroxy-5β-cholan-24-oyl)-L-β-homophenylalanine

Guidance literature:

Multi-step reaction with 3 steps

1: acetyl chloride / 0 °C / Inert atmosphere; Reflux

2: 4-methyl-morpholine; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride / dichloromethane / 20 °C / Inert atmosphere

3: sodium hydroxide / ethanol / 1 h / 20 °C / Inert atmosphere

With 4-methyl-morpholine; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; acetyl chloride; sodium hydroxide; In ethanol; dichloromethane;

DOI:10.1021/acs.jmedchem.6b01642

upstream raw materials:

(S)-3-amino-4-phenylbutanoic acid

Downstream raw materials:

homo-β-phenylalanine methyl ester

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