1-Iodo-4-nitrobenzene (C6H4INO2)

1-Iodo-4-nitrobenzene (C6H4INO2; CAS 636-98-6) is a practical retrosynthesis target. 1-Iodo-4-nitrobenzene presents a C6 framework, aromatic rings, a nitro group. Open AI route search in one click below.

Target: 1-Iodo-4-nitrobenzene
CAS: 636-98-6
Formula: C6H4INO2
Approx. MW: 249.00
SMILES: O=[N+]([O-])c1ccc(I)cc1
PubChem CID: 12495
Approx. carbons: C6

1-Iodo-4-nitrobenzene structure

Properties

Molecular weight: 249.00

View on PubChem

1-Iodo-4-nitrobenzene 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 1-Iodo-4-nitrobenzene?

1-Iodo-4-nitrobenzene has molecular formula C6H4INO2. Molecular weight about 249.00 g·mol⁻¹.

What is the CAS number of 1-Iodo-4-nitrobenzene?

The CAS Registry Number for 1-Iodo-4-nitrobenzene is 636-98-6.

Run AI retrosynthesis for 1-Iodo-4-nitrobenzene Target catalog AI tools overview

Start from this SMILES and explore AI retrosynthesis routes for C6H4INO2.

Related targets

Similar compounds

1-Iodo-3-nitrobenzene 1-Bromo-2-nitrobenzene 1-Bromo-3-nitrobenzene 1-Bromo-4-nitrobenzene 1-Chloro-3-nitrobenzene 1,2-dichloro-4-nitrobenzene

Browse the full target catalog

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.