3-Chlorobenzyl cyanide (C8H6ClN)

Looking for routes to 3-Chlorobenzyl cyanide? 3-Chlorobenzyl cyanide presents a C8 framework, aromatic rings, basic nitrogen. Use the planner with prefilled SMILES, or copy N#CCc1cccc(Cl)c1 (CAS 1529-41-5).

Target: 3-Chlorobenzyl cyanide
CAS: 1529-41-5
Formula: C8H6ClN
Approx. MW: 151.59
SMILES: N#CCc1cccc(Cl)c1
PubChem CID: 73722
Approx. carbons: C8

3-Chlorobenzyl cyanide structure

Properties

Molecular weight: 151.59

View on PubChem

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

FAQ

What is the chemical formula of 3-Chlorobenzyl cyanide?

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

What is the CAS number of 3-Chlorobenzyl cyanide?

The CAS Registry Number for 3-Chlorobenzyl cyanide is 1529-41-5.

Run AI retrosynthesis for 3-Chlorobenzyl cyanide Target catalog AI tools overview

Open the planner with 3-Chlorobenzyl cyanide preloaded, then keep routes that match CAS 1529-41-5.

Related targets

Similar compounds

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

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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.