2-Amino-3-phenylbutanoic acid hydrochloride

Base Information

• Chemical Name: 2-Amino-3-phenylbutanoic acid hydrochloride
• CAS No.: 80997-87-1
• Molecular Formula: C10H14ClNO2
• Molecular Weight: 215.68
• Hs Code.: 29224985
• European Community (EC) Number: 279-646-2
• DSSTox Substance ID: DTXSID901001690
• Mol file: 80997-87-1.mol

Synonyms:2-amino-3-phenylbutanoic acid hydrochloride;80997-87-1;2-amino-3-phenylbutanoic acid;hydrochloride;L-Phenylalanine, b-methyl-, hydrochloride, threo-;D-Phenylalanine, b-methyl-, hydrochloride, erythro-;L-Phenylalanine, b-methyl-, hydrochloride, erythro-;53331-55-8;143251-57-4;(2R,3S)-2-Amino-3-phenylbutanoic acid hydrochloride;143282-81-9;EINECS 279-646-2;beta-Methyl-3-phenyl-DL-alanine HCl;beta-Methyl-3-phenyl-DL-alanine hydrochloride;SCHEMBL2317097;SGKWQBMDOXGYAA-UHFFFAOYSA-N;DTXSID901001690;MFCD00012623;MFCD18382031;AKOS022175680;SB33620;SB33621;SB33623;SB37543;beta-Methyl(dl)phenylalanine hydrochloride;beta-Methyl-DL-phenylalanine hydrochloride;DS-12942;SY355220;beta -Methyl-DL-phenylalanine hydrochloride;2-amino-3-phenyl-butanoic acid hydrochloride;CS-0128763;FT-0641795;EN300-298867;A840017;beta-Methylphenylalanine--hydrogen chloride (1/1);2-Amino-3-phenylbutanoic acid hydrochloride (H-DL-Phe(b-Me)-OH.HCl)

Chemical Property of 2-Amino-3-phenylbutanoic acid hydrochloride

Chemical Property:

• Appearance/Colour: White powder to beige powder
• Vapor Pressure: 3.85E-05mmHg at 25°C
• Melting Point: 210 °C(lit.)
• Boiling Point: 338.4 °C at 760 mmHg
• Flash Point: 158.4 °C
• PSA: 63.32000
• LogP: 2.70430
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 215.0713064
• Heavy Atom Count: 14
• Complexity: 176

Purity/Quality:

≥97% ^*data from raw suppliers

2-Amino-3-phenylbutanoicacidHCl ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 2-Amino-3-phenylbutanoic acid hydrochloride

There total 6 articles about 2-Amino-3-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: 75.0%

diethyl (acetylamino)(1-phenylethyl)malonate (59850-50-9) → 2-amino-3-phenylbutanoic acid hydrochloride (80997-87-1,59850-51-0)

Guidance literature:

With hydrogenchloride; at 90 - 100 ℃; for 16h;

DOI:10.1021/jo070878+

Reference yield:

diethyl (acetylamino)(1-phenylvinyl)malonate (949887-00-7) → 2-amino-3-phenylbutanoic acid hydrochloride (80997-87-1,59850-51-0)

Guidance literature:

Multi-step reaction with 2 steps

1: 100 percent / H₂ / Pd on carbon / ethanol / 2 h / 20 - 25 °C / 2585.81 Torr

2: 75 percent / aq. HCl / 16 h / 90 - 100 °C

With hydrogenchloride; hydrogen; palladium on activated charcoal; In ethanol;

DOI:10.1021/jo070878+

Reference yield:

phenylacetylene (536-74-3) → 2-amino-3-phenylbutanoic acid hydrochloride (80997-87-1,59850-51-0)

Guidance literature:

Multi-step reaction with 3 steps

1: 85 percent / indium(III) triflate; N-methylmorpholine / 3 h / 130 - 140 °C

2: 100 percent / H₂ / Pd on carbon / ethanol / 2 h / 20 - 25 °C / 2585.81 Torr

3: 75 percent / aq. HCl / 16 h / 90 - 100 °C

With indium(III) triflate; 4-methyl-morpholine; hydrogenchloride; hydrogen; palladium on activated charcoal; In ethanol;

DOI:10.1021/jo070878+

upstream raw materials:

(1-bromoethyl)benzne

2-acetylaminomalonic acid diethyl ester

diethyl (acetylamino)(1-phenylethyl)malonate

diethyl (acetylamino)(1-phenylvinyl)malonate

Post a RFQ

Cas No.:

Product Name:

Quantity:

Please select Metric Ton KG G Pound L ML

Email:

Company name:

Valid Period:

Detailed Requirements:

• Sample
• MOQ
• GMP
• FDA
• Price
  FOB CIF CFR EXW
• Urgent purchase

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

Remove

Submit

1

What can I do for you?
Get Best Price

Get Best Price for 80997-87-1 2-AMINO-3-PHENYLBUTANOIC ACID HYDROCHLORIDE

Send

Send

Metric Ton KG G Pound L ML

Send

Send