3-Nitrobenzenesulfonyl chloride (C6H4ClNO4S)

3-Nitrobenzenesulfonyl chloride (C6H4ClNO4S; CAS 121-51-7) is a practical retrosynthesis target. 3-Nitrobenzenesulfonyl chloride presents a C6 framework, aromatic rings, a nitro group. Open AI route search in one click below.

Target: 3-Nitrobenzenesulfonyl chloride
CAS: 121-51-7
Formula: C6H4ClNO4S
Approx. MW: 221.61
SMILES: O=[N+]([O-])c1cccc(S(=O)(=O)Cl)c1
PubChem CID: 8476
Approx. carbons: C6

3-Nitrobenzenesulfonyl chloride structure

Properties

Molecular weight: 221.61

View on PubChem

3-Nitrobenzenesulfonyl chloride 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 3-Nitrobenzenesulfonyl chloride?

3-Nitrobenzenesulfonyl chloride has molecular formula C6H4ClNO4S. Molecular weight about 221.61 g·mol⁻¹.

What is the CAS number of 3-Nitrobenzenesulfonyl chloride?

The CAS Registry Number for 3-Nitrobenzenesulfonyl chloride is 121-51-7.

Run AI retrosynthesis for 3-Nitrobenzenesulfonyl chloride Target catalog AI tools overview

Open the planner with 3-Nitrobenzenesulfonyl chloride preloaded, then keep routes that match CAS 121-51-7.

Related targets

Similar compounds

4-Nitrobenzenesulfonyl chloride 1-Bromo-2-nitrobenzene 1-Bromo-3-nitrobenzene 1-Bromo-4-nitrobenzene 1-Chloro-3-nitrobenzene 1-Iodo-3-nitrobenzene

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References & tools

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