4-(1-Amino-2-tert-butoxy-1-carboxy-2-oxoethyl)-1,2-dichlorobenzene

Base Information

• Chemical Name: 4-(1-Amino-2-tert-butoxy-1-carboxy-2-oxoethyl)-1,2-dichlorobenzene
• CAS No.: 142121-95-7
• Molecular Formula: C13H15Cl2NO4
• Molecular Weight: 320.17
• DSSTox Substance ID: DTXSID20692926
• Mol file: 142121-95-7.mol

Synonyms:DTXSID20692926;4-(1-Amino-2-tert-butoxy-1-carboxy-2-oxoethyl)-1,2-dichlorobenzene

Chemical Property of 4-(1-Amino-2-tert-butoxy-1-carboxy-2-oxoethyl)-1,2-dichlorobenzene

Chemical Property:

• PSA: 75.63000
• LogP: 4.03470
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 319.0378133
• Heavy Atom Count: 20
• Complexity: 396

Purity/Quality:

97% ^*data from raw suppliers

2-(Boc-amino)-2-(3,4-dichlorophenyl)aceticAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 4-(1-Amino-2-tert-butoxy-1-carboxy-2-oxoethyl)-1,2-dichlorobenzene

There total 3 articles about 4-(1-Amino-2-tert-butoxy-1-carboxy-2-oxoethyl)-1,2-dichlorobenzene 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: 48.0%

di-tert-butyl dicarbonate (24424-99-5) + α-amino-3,4-dichloro-phenylacetic acid (128349-50-8) → 3,4-dichloro-α-<<(1,1-dimethylethoxy)carbonyl>amino>-benzeneacetic acid (142121-95-7,1241683-86-2)

Guidance literature:

With sodium hydroxide; In tert-butyl alcohol; for 24h; Ambient temperature;

DOI:10.1021/jm00055a002

Reference yield:

(3,4-dichlorophenyl)hydroxyiminoacetic acid (146621-85-4) → 3,4-dichloro-α-<<(1,1-dimethylethoxy)carbonyl>amino>-benzeneacetic acid (142121-95-7,1241683-86-2)

Guidance literature:

Multi-step reaction with 2 steps

1: 57 percent / H₂, conc aq. HCl / 5percent Pd/C / ethanol / 6 h / 760 Torr / Ambient temperature

2: 48 percent / 2N aq. NaOH / 2-methyl-propan-2-ol / 24 h / Ambient temperature

With hydrogenchloride; sodium hydroxide; hydrogen; palladium on activated charcoal; In ethanol; tert-butyl alcohol;

DOI:10.1021/jm00055a002

Reference yield:

3,4-dichloro-benzeneacetonitrile (3218-49-3) → 3,4-dichloro-α-<<(1,1-dimethylethoxy)carbonyl>amino>-benzeneacetic acid (142121-95-7,1241683-86-2)

Guidance literature:

Multi-step reaction with 3 steps

1: 98 percent / isobutyl nitrite, aq. KOH / methanol / 26 h / 50 - 90 °C

2: 57 percent / H₂, conc aq. HCl / 5percent Pd/C / ethanol / 6 h / 760 Torr / Ambient temperature

3: 48 percent / 2N aq. NaOH / 2-methyl-propan-2-ol / 24 h / Ambient temperature

With hydrogenchloride; potassium hydroxide; sodium hydroxide; nitrous acid isobutyl ester; hydrogen; palladium on activated charcoal; In methanol; ethanol; tert-butyl alcohol;

DOI:10.1021/jm00055a002

upstream raw materials:

di-tert-butyl dicarbonate

α-amino-3,4-dichloro-phenylacetic acid

(3,4-dichlorophenyl)hydroxyiminoacetic acid

3,4-dichloro-benzeneacetonitrile

Downstream raw materials:

C₃₂H₄₀Cl₂N₆O₇

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 142121-95-7 TERT-BUTOXYCARBONYLAMINO-(3,4-DICHLORO-PHENYL)-ACETIC ACID

Send

Send

Metric Ton KG G Pound L ML

Send

Send