1-(3-Fluoro-4-iodophenyl)cyclopropane-1-carboxylic acid

Base Information

Chemical Name:1-(3-Fluoro-4-iodophenyl)cyclopropane-1-carboxylic acid
CAS No.:884905-30-0
Molecular Formula:C₁₀H₈FIO₂
Molecular Weight:306.075
Hs Code.:
DSSTox Substance ID:DTXSID401219905

Synonyms:884905-30-0;DTXSID401219905;1-(3-Fluoro-4-iodophenyl)cyclopropanecarboxylic acid

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Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 1-(3-Fluoro-4-iodophenyl)cyclopropane-1-carboxylic acid

Chemical Property:

XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:305.95531
Heavy Atom Count:14
Complexity:253

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1CC1(C2=CC(=C(C=C2)I)F)C(=O)O

Technology Process of 1-(3-Fluoro-4-iodophenyl)cyclopropane-1-carboxylic acid

There total 5 articles about 1-(3-Fluoro-4-iodophenyl)cyclopropane-1-carboxylic acid 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:

: 499983-13-0
2-( 4-bromo-3-fluorophenyl)acetonitrile

: 884905-30-0
1-(3-fluoro-4-iodophenyl)cyclopropanecarboxylic acid

Guidance literature:: Multi-step reaction with 3 steps

1: 91 percent / aq. NaOH; tetrabutylammonium bromide / toluene / 4 h / 20 °C

2: 76 percent / aq. NaOH / methanol / 8 h / 100 °C

3: KI; Ni; I₂ / dimethylformamide / 2 h / 140 °C

With sodium hydroxide; tetrabutylammomium bromide; iodine; nickel; potassium iodide; In methanol; N,N-dimethyl-formamide; toluene;
DOI:10.1021/jm0502541

Reference yield:

: 749269-74-7
1-(4-bromo-3-fluorophenyl)cyclopropanecarboxylic acid

: 884905-30-0
1-(3-fluoro-4-iodophenyl)cyclopropanecarboxylic acid

Guidance literature:: With iodine; nickel; potassium iodide; In N,N-dimethyl-formamide; at 140 ℃; for 2h;
DOI:10.1021/jm0502541

Reference yield:

: 127425-73-4
1-bromo-4-(bromomethyl)-2-fluorobenzene

: 884905-30-0
1-(3-fluoro-4-iodophenyl)cyclopropanecarboxylic acid

Guidance literature:: Multi-step reaction with 4 steps

1: 5 g / ethanol / 2 h / 80 °C

2: 91 percent / aq. NaOH; tetrabutylammonium bromide / toluene / 4 h / 20 °C

3: 76 percent / aq. NaOH / methanol / 8 h / 100 °C

4: KI; Ni; I₂ / dimethylformamide / 2 h / 140 °C

With sodium hydroxide; tetrabutylammomium bromide; iodine; nickel; potassium iodide; In methanol; ethanol; N,N-dimethyl-formamide; toluene;
DOI:10.1021/jm0502541