2-Chloro-5-(trifluoromethyl)benzonitrile (C8H3ClF3N)

2-Chloro-5-(trifluoromethyl)benzonitrile presents a C8 framework, aromatic rings, basic nitrogen (formula C8H3ClF3N, CAS 328-87-0). ChemicalTool Reaction can propose ranked disconnections for 2-Chloro-5-(trifluoromethyl)benzonitrile from the SMILES N#Cc1cc(C(F)(F)F)ccc1Cl.

Target: 2-Chloro-5-(trifluoromethyl)benzonitrile
CAS: 328-87-0
Formula: C8H3ClF3N
Approx. MW: 205.56
SMILES: N#Cc1cc(C(F)(F)F)ccc1Cl
PubChem CID: 67604
Approx. carbons: C8

2-Chloro-5-(trifluoromethyl)benzonitrile structure

Properties

Molecular weight: 205.56

View on PubChem

2-Chloro-5-(trifluoromethyl)benzonitrile 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 2-Chloro-5-(trifluoromethyl)benzonitrile?

2-Chloro-5-(trifluoromethyl)benzonitrile has molecular formula C8H3ClF3N. Molecular weight about 205.56 g·mol⁻¹.

What is the CAS number of 2-Chloro-5-(trifluoromethyl)benzonitrile?

The CAS Registry Number for 2-Chloro-5-(trifluoromethyl)benzonitrile is 328-87-0.

Run AI retrosynthesis for 2-Chloro-5-(trifluoromethyl)benzonitrile Target catalog AI tools overview

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Related targets

Similar compounds

(Pentafluorophenyl)acetonitrile 1-(4-Fluorophenyl)ethylamine 2-(2-Chlorophenyl)ethylamine 2-(Trifluoromethoxy)benzonitrile 2-(Trifluoromethyl)benzylamine 2-Fluoro-4-(trifluoromethyl)benzonitrile

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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.