2-Ethylhexyl cyanoacetate (C11H19NO2)

2-Ethylhexyl cyanoacetate presents a C11 framework, basic nitrogen (formula C11H19NO2, CAS 13361-34-7). ChemicalTool Reaction can propose ranked disconnections for 2-Ethylhexyl cyanoacetate from the SMILES CCCCC(CC)COC(=O)CC#N.

Target: 2-Ethylhexyl cyanoacetate
CAS: 13361-34-7
Formula: C11H19NO2
Approx. MW: 197.28
SMILES: CCCCC(CC)COC(=O)CC#N
PubChem CID: 96359
Approx. carbons: C11

2-Ethylhexyl cyanoacetate structure

Properties

Molecular weight: 197.28

View on PubChem

2-Ethylhexyl cyanoacetate 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 2-Ethylhexyl cyanoacetate?

2-Ethylhexyl cyanoacetate has molecular formula C11H19NO2. Molecular weight about 197.28 g·mol⁻¹.

What is the CAS number of 2-Ethylhexyl cyanoacetate?

The CAS Registry Number for 2-Ethylhexyl cyanoacetate is 13361-34-7.

Run AI retrosynthesis for 2-Ethylhexyl cyanoacetate Target catalog AI tools overview

One click loads 2-Ethylhexyl cyanoacetate into ChemicalTool Reaction for route exploration.

Related targets

Similar compounds

adamantyl isothiocyanate 1-(methylsulfonyl)indoline 2-methyltetrahydroquinoline 3-(triethoxysilyl)propionitrile 3-Aminopropyltriethoxysilane 3-APDPO cpd

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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.