2-Amino-2'-fluoro-5-nitrobenzophenone

Base Information

• Chemical Name: 2-Amino-2'-fluoro-5-nitrobenzophenone
• CAS No.: 344-80-9
• Molecular Formula: C13H9FN2O3
• Molecular Weight: 260.224
• Hs Code.: 29223990
• European Community (EC) Number: 206-454-8
• DSSTox Substance ID: DTXSID70187973
• Nikkaji Number: J193.793F
• Wikidata: Q72437245
• Mol file: 344-80-9.mol

Synonyms:2-Amino-2'-fluoro-5-nitrobenzophenone;344-80-9;(2-Amino-5-nitrophenyl)(2-fluorophenyl)methanone;2-AMINO-5-NITRO-2'-FLUOROBENZOPHENONE;(2-amino-5-nitrophenyl)-(2-fluorophenyl)methanone;C13H9FN2O3;EINECS 206-454-8;Methanone, (2-amino-5-nitrophenyl)(2-fluorophenyl)-;2-Amino-2-Fluoro-5-Nitrobenzophenone;2-amino-5-nitro-2'-fluoro-benzophenone;2-Amino-5-nitro-2''-fluorobenzophenone;2-Amino-5-Nitro -2'-Fluoro Benzophenone;SCHEMBL7318800;DTXSID70187973;MFCD00970341;AKOS015890651;2-Amino-2/'-fluoro-5-nitrobenzophenone;9-Methoxy-1-(methoxymethyl)-9H-fluorene;AC-16286;AS-12586;Benzophenone, 2-amino-2'-fluoro-5-nitro;CS-0156718;FT-0631991;D97513;A822252;Q-200227

Chemical Property of 2-Amino-2'-fluoro-5-nitrobenzophenone

Chemical Property:

• Appearance/Colour: yellow crystalline powder
• Melting Point: 158-160°C
• Boiling Point: 485.6 °C at 760 mmHg
• PKA: -3.19±0.36(Predicted)
• Flash Point: 247.5 °C
• PSA: 88.91000
• Density: 1.399 g/cm³
• LogP: 3.65150
• Storage Temp.: Refrigerator
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 260.05972032
• Heavy Atom Count: 19
• Complexity: 358

Purity/Quality:

99% ^*data from raw suppliers

2-Amino-5-nitro-2''-fluorobenzophenone ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N)F
• Uses: Intermediate in the production of Flunitrazepam metabolites.

Technology Process of 2-Amino-2'-fluoro-5-nitrobenzophenone

There total 2 articles about 2-Amino-2'-fluoro-5-nitrobenzophenone 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:

5-(2-fluorophenyl)-1,3-dihydro-7-nitro-2H-1,4-benzodiazepin-2-one (2558-30-7) → 2-amino-5-nitro-2'-fluorobenzophenone (344-80-9)

Guidance literature:

With hydrogenchloride; In ethanol; Heating;

DOI:10.1021/jm00339a010

Reference yield:

→ 2-amino-5-nitro-2'-fluorobenzophenone (344-80-9)

Guidance literature:

o-FC6H4COCl, p-NO2C6H4NH2, ZnCl2;

Reference yield: 95.0%

2-amino-5-nitro-2'-fluorobenzophenone (344-80-9) + chloroacetyl chloride (79-04-9) → 2?(2?chloroacetamido)?5?nitro?2′?fluorobenzophenone

Guidance literature:

In dichloromethane; at 0 - 20 ℃; for 12h;

DOI:10.1007/s13738-018-1555-0

upstream raw materials:

5-(2-fluorophenyl)-1,3-dihydro-7-nitro-2H-1,4-benzodiazepin-2-one

Downstream raw materials:

(S)-benzyl-{1-[[2-(o-fluorobenzoyl)-4-nitrophenyl]carbamoyl]ethyl}carbamate

2-chloromethyl-4-(2-fluoro-phenyl)-6-nitro-1,2-dihydro-quinazoline 3-oxide

(-)-benzyl-[1-[{2-(o-fluorobenzoyl)-4-nitrophenyl}-carbamoyl]ethyl]carbamate

3-fluoro-5-o-fluorophenyl-7-nitro-2,3-dihydro-1H-1,4-benzodiazepin-2-one