4-Chlorobenzyl cyanide (C8H6ClN)

4-Chlorobenzyl cyanide presents a C8 framework, aromatic rings, basic nitrogen (formula C8H6ClN, CAS 140-53-4). ChemicalTool Reaction can propose ranked disconnections for 4-Chlorobenzyl cyanide from the SMILES N#CCc1ccc(Cl)cc1.

Target: 4-Chlorobenzyl cyanide
CAS: 140-53-4
Formula: C8H6ClN
Approx. MW: 151.59
SMILES: N#CCc1ccc(Cl)cc1
PubChem CID: 241582
Approx. carbons: C8

4-Chlorobenzyl cyanide structure

Properties

Molecular weight: 151.59

View on PubChem

4-Chlorobenzyl cyanide 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 4-Chlorobenzyl cyanide?

4-Chlorobenzyl cyanide has molecular formula C8H6ClN. Molecular weight about 151.59 g·mol⁻¹.

What is the CAS number of 4-Chlorobenzyl cyanide?

The CAS Registry Number for 4-Chlorobenzyl cyanide is 140-53-4.

Run AI retrosynthesis for 4-Chlorobenzyl cyanide Target catalog AI tools overview

Open the planner with 4-Chlorobenzyl cyanide preloaded, then keep routes that match CAS 140-53-4.

Related targets

Similar compounds

3-Chlorobenzyl cyanide (Pentafluorophenyl)acetonitrile 1-(4-Fluorophenyl)ethylamine 2-(2-Chlorophenyl)ethylamine 2-(Trifluoromethoxy)benzonitrile 2-(Trifluoromethyl)benzylamine

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.