2-Amino-5-fluoro-N-methoxy-N-methylbenzamide

Base Information

• Chemical Name: 2-Amino-5-fluoro-N-methoxy-N-methylbenzamide
• CAS No.: 880875-39-8
• Molecular Formula: C9H11FN2O2
• Molecular Weight: 198.197
• DSSTox Substance ID: DTXSID40695939
• Wikidata: Q82625328

Synonyms:2-Amino-5-fluoro-N-methoxy-N-methylbenzamide;880875-39-8;2-AMINO-5-FLUORO-N-METHOXY-N-METHYL-BENZAMIDE;SCHEMBL2472646;DTXSID40695939;BJTPURUYKCXYGM-UHFFFAOYSA-N;MFCD12800122;SB39331;AS-43507;CS-0238977;EN300-203585

Chemical Property of 2-Amino-5-fluoro-N-methoxy-N-methylbenzamide

Chemical Property:

• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 198.08045576
• Heavy Atom Count: 14
• Complexity: 213

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 2-Amino-5-fluoro-N-methoxy-N-methylbenzamide

There total 4 articles about 2-Amino-5-fluoro-N-methoxy-N-methylbenzamide 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: 81.0%

6-fluoro-2H-benzo[e][1,3]oxazine-2,4(3H)-dione (134792-45-3) + N,O-dimethylhydroxylamine*hydrochloride (6638-79-5) → 2-amino-5-fluoro-N-methoxy-N-methylbenzamide (880875-39-8)

Guidance literature:

With triethylamine; In ethanol; water; for 16h; Heating / reflux;

Reference yield: 39.0%

5-fluoroisatoic anhydride (321-69-7) + N,O-dimethylhydroxylamine*hydrochloride (6638-79-5) → 2-amino-5-fluoro-N-methoxy-N-methylbenzamide (880875-39-8)

Guidance literature:

N,O-dimethylhydroxylamine*hydrochloride; With triethylamine; In ethanol; for 0.166667h;

5-fluoroisatoic anhydride; In ethanol; for 2h; Reflux;

DOI:10.1021/jm400652r

Reference yield:

2-amino-5-fluorobenzoic acid (446-08-2) + N,O-dimethylhydroxylamine*hydrochloride (6638-79-5) → 2-amino-5-fluoro-N-methoxy-N-methylbenzamide (880875-39-8)

Guidance literature:

With N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; N-ethyl-N,N-diisopropylamine; In chloroform; at 0 - 20 ℃; for 2h;

upstream raw materials:

6-fluoro-2H-benzo[e][1,3]oxazine-2,4(3H)-dione

N,O-dimethylhydroxylamine*hydrochloride

2-amino-5-fluorobenzoic acid

5-fluoroisatoic anhydride

Downstream raw materials:

(2-amino-5-fluorophenyl)(4-chlorophenyl)methanone

(2-amino-5-fluorophenyl)(3-fluorophenyl)methanone

(E)-4-(4-chlorophenyl)-3-[3-(4-chlorophenyl)acryloyl]-6-fluoroquinolin-2(1H)-one

(E)-3[3-(4-chlorophenyl)acryloyl]-6-fluoro-4-(3-fluorophenyl)quinolin-2(1H)-one

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