Formamide, N-(2-chlorophenyl)-

Base Information

• Chemical Name: Formamide, N-(2-chlorophenyl)-
• CAS No.: 2596-93-2
• Molecular Formula: C7H6 Cl N O
• Molecular Weight: 155.584
• European Community (EC) Number: 621-716-5
• NSC Number: 30093
• DSSTox Substance ID: DTXSID70180626
• Nikkaji Number: J145.254A
• Wikidata: Q83051199
• Mol file: 2596-93-2.mol

Synonyms:N-(2-Chlorophenyl)formamide;2596-93-2;Formamide, N-(2-chlorophenyl)-;2'-Chloroformanilide;Formanilide, 2'-chloro-;N-(2-chlorophenyl)-formamide;N-(2-Chloro-phenyl)formamide;NSC30093;2-Chlorophenylformamide #;SCHEMBL227131;DTXSID70180626;DGRDTMLQUWBPSM-UHFFFAOYSA-N;N-(2-Chlorophenyl)formamide, 97%;NSC 30093;NSC-30093;AKOS012525043;FT-0693622;J-016197

Chemical Property of Formamide, N-(2-chlorophenyl)-

Chemical Property:

• Vapor Pressure: 0.000417mmHg at 25°C
• Melting Point: 76-80 °C(lit.)
• Boiling Point: 316.2°Cat760mmHg
• PKA: 14.07±0.70(Predicted)
• Flash Point: 145°C
• PSA: 29.10000
• Density: 1.316g/cm³
• LogP: 2.61720
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 155.0137915
• Heavy Atom Count: 10
• Complexity: 118

Purity/Quality:

2'-CHLOROFORMANILIDE Aldrich ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 22-36-42/43
• Safety Statements: 22-26-36/37-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

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

Technology Process of Formamide, N-(2-chlorophenyl)-

There total 30 articles about Formamide, N-(2-chlorophenyl)- 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: 98.0%

N,N-dimethyl-formamide (68-12-2,33513-42-7) + o-chloroaniline (95-51-2) → 2-chloro-N-phenylformamide (2596-93-2)

Guidance literature:

With potassium tert-butylate; at 25 ℃; for 2h; Inert atmosphere;

DOI:10.1002/ejoc.201900666

Reference yield: 96.0%

formic acid (64-18-6) + o-chloroaniline (95-51-2) → 2-chloro-N-phenylformamide (2596-93-2)

Guidance literature:

formic acid; With silica gel; at 20 ℃; for 0.0166667h;

o-chloroaniline; With silica gel; at 110 ℃; for 0.0416667h;

Reference yield: 96.0%

formic acid (64-18-6) + 2-Chloronitrobenzene (88-73-3) → 2-chloro-N-phenylformamide (2596-93-2)

Guidance literature:

With gold nano particles supported on rutile TiO₂; In toluene; at 70 ℃; for 4h; under 750.075 Torr; chemoselective reaction; Inert atmosphere;

DOI:10.1002/cssc.201500869

upstream raw materials:

sodium methylate

N,N-dimethyl-formamide

o-chloroaniline

formic acid

Downstream raw materials:

N-ethyl-2-chloro-N-nitroso-aniline

1-(2-chlorophenyl)-1H-1,2,3,4-tetrazole

2-Chlor-phenylimino-kohlensaeure-thiopentachlor-phenylester-chlorid

N-(2-chlorophenyl) carbonimidoyl dichloride