4-Iodobenzotrifluoride (C7H4F3I)

4-Iodobenzotrifluoride presents a C7 framework, aromatic rings, halogen substitution (formula C7H4F3I, CAS 455-13-0). ChemicalTool Reaction can propose ranked disconnections for 4-Iodobenzotrifluoride from the SMILES FC(F)(F)c1ccc(I)cc1.

Target: 4-Iodobenzotrifluoride
CAS: 455-13-0
Formula: C7H4F3I
Approx. MW: 272.00
SMILES: FC(F)(F)c1ccc(I)cc1
PubChem CID: 67993
Approx. carbons: C7

4-Iodobenzotrifluoride structure

Properties

Molecular weight: 272.00

View on PubChem

4-Iodobenzotrifluoride 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 4-Iodobenzotrifluoride?

4-Iodobenzotrifluoride has molecular formula C7H4F3I. Molecular weight about 272.00 g·mol⁻¹.

What is the CAS number of 4-Iodobenzotrifluoride?

The CAS Registry Number for 4-Iodobenzotrifluoride is 455-13-0.

Run AI retrosynthesis for 4-Iodobenzotrifluoride Target catalog AI tools overview

Open the planner with 4-Iodobenzotrifluoride preloaded, then keep routes that match CAS 455-13-0.

Related targets

Similar compounds

(Trifluoromethoxy)benzene 1-(Dichloromethyl)-4-fluorobenzene 1-Chloro-4-(trifluoromethoxy)benzene 1-Iodo-4-(trifluoromethoxy)benzene 3-Chlorobenzyl chloride 4-(Trifluoromethoxy)aniline

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References & tools

ChemicalTool Reaction — AI retrosynthesis with optional library evidence.
PubChem — compound identifiers and structure depictions (NIH/NCBI).
Related: AiZynthFinder / synthesis planning literature for computer-aided retrosynthesis.