5-Fluoro-2-methoxybenzonitrile (C8H6FNO)

Looking for routes to 5-Fluoro-2-methoxybenzonitrile? 5-Fluoro-2-methoxybenzonitrile presents a C8 framework, aromatic rings, basic nitrogen. Use the planner with prefilled SMILES, or copy COc1ccc(F)cc1C#N (CAS 189628-38-4).

Target: 5-Fluoro-2-methoxybenzonitrile
CAS: 189628-38-4
Formula: C8H6FNO
Approx. MW: 151.14
SMILES: COc1ccc(F)cc1C#N
PubChem CID: 2782746
Approx. carbons: C8

5-Fluoro-2-methoxybenzonitrile structure

Properties

IUPAC name: 5-fluoro-2-methoxybenzonitrile
Common names: 5-Fluoro-2-methoxybenzonitrile; 189628-38-4; XNCVSNKXADJGOG-UHFFFAOYSA-; DTXSID50382262; RefChem:102626; DTXCID80333287; 606-184-4; InChI=1/C8H6FNO/c1-11-8-3-2-7(9)4-6(8)5-10/h2-4H,1H3; 2-Cyano-4-fluoroanisole; Benzonitrile, 5-fluoro-2-methoxy-
Molecular weight: 151.14
Exact mass: 151.04
InChIKey: XNCVSNKXADJGOG-UHFFFAOYSA-N

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5-Fluoro-2-methoxybenzonitrile 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 5-Fluoro-2-methoxybenzonitrile?

5-Fluoro-2-methoxybenzonitrile has molecular formula C8H6FNO. Molecular weight about 151.14 g·mol⁻¹.

What is the CAS number of 5-Fluoro-2-methoxybenzonitrile?

The CAS Registry Number for 5-Fluoro-2-methoxybenzonitrile is 189628-38-4.

Run AI retrosynthesis for 5-Fluoro-2-methoxybenzonitrile Target catalog AI tools overview

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Related targets

Similar compounds

2-fluoro-4-methoxybenzonitrile (Pentafluorophenyl)acetonitrile 1-(4-Fluorophenyl)ethylamine 2-(2-Chlorophenyl)ethylamine 2-(Trifluoromethoxy)benzonitrile 2-(Trifluoromethyl)benzylamine

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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.