4-Chloroaniline (C6H6ClN)

4-Chloroaniline presents a C6 framework, aromatic rings, halogen substitution (formula C6H6ClN, CAS 106-47-8). ChemicalTool Reaction can propose ranked disconnections for 4-Chloroaniline from the SMILES Nc1ccc(Cl)cc1.

Target: 4-Chloroaniline
CAS: 106-47-8
Formula: C6H6ClN
Approx. MW: 127.57
SMILES: Nc1ccc(Cl)cc1
PubChem CID: 7812
Approx. carbons: C6

4-Chloroaniline structure

Properties

Molecular weight: 127.57

View on PubChem

4-Chloroaniline 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 4-Chloroaniline?

4-Chloroaniline has molecular formula C6H6ClN. Molecular weight about 127.57 g·mol⁻¹.

What is the CAS number of 4-Chloroaniline?

The CAS Registry Number for 4-Chloroaniline is 106-47-8.

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

Start from this SMILES and explore AI retrosynthesis routes for C6H6ClN.

Related targets

Similar compounds

2-(Chloromethyl)pyridine 2-Chloroaniline 3-Chloroaniline (3-bromophenyl)boronic Acid 1-Bromo-2-chloro-3-fluorobenzene 1-Bromo-2-chlorobenzene

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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.