1-Chloro-3-nitrobenzene (C6H4ClNO2)

1-Chloro-3-nitrobenzene presents a C6 framework, aromatic rings, a nitro group (formula C6H4ClNO2, CAS 121-73-3). ChemicalTool Reaction can propose ranked disconnections for 1-Chloro-3-nitrobenzene from the SMILES O=[N+]([O-])c1cccc(Cl)c1.

Target: 1-Chloro-3-nitrobenzene
CAS: 121-73-3
Formula: C6H4ClNO2
Approx. MW: 157.55
SMILES: O=[N+]([O-])c1cccc(Cl)c1
PubChem CID: 8489
Approx. carbons: C6

1-Chloro-3-nitrobenzene structure

Properties

Molecular weight: 157.55

View on PubChem

1-Chloro-3-nitrobenzene 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 1-Chloro-3-nitrobenzene?

1-Chloro-3-nitrobenzene has molecular formula C6H4ClNO2. Molecular weight about 157.55 g·mol⁻¹.

What is the CAS number of 1-Chloro-3-nitrobenzene?

The CAS Registry Number for 1-Chloro-3-nitrobenzene is 121-73-3.

Run AI retrosynthesis for 1-Chloro-3-nitrobenzene Target catalog AI tools overview

Open the planner with 1-Chloro-3-nitrobenzene preloaded, then keep routes that match CAS 121-73-3.

Related targets

Similar compounds

2-Chloronitrobenzene 4-Chloronitrobenzene 1-Bromo-2-nitrobenzene 1-Bromo-3-nitrobenzene 1-Bromo-4-nitrobenzene 1-Iodo-3-nitrobenzene

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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.