Ethyl 2-bromohexanoate (C8H15BrO2)

Ethyl 2-bromohexanoate presents a C8 framework, an ester, halogen substitution (formula C8H15BrO2, CAS 615-96-3). ChemicalTool Reaction can propose ranked disconnections for Ethyl 2-bromohexanoate from the SMILES CCCCC(Br)C(=O)OCC.

Target: Ethyl 2-bromohexanoate
CAS: 615-96-3
Formula: C8H15BrO2
Approx. MW: 223.11
SMILES: CCCCC(Br)C(=O)OCC
PubChem CID: 79072
Approx. carbons: C8

Ethyl 2-bromohexanoate structure

Properties

Molecular weight: 223.11

View on PubChem

Ethyl 2-bromohexanoate 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of Ethyl 2-bromohexanoate?

Ethyl 2-bromohexanoate has molecular formula C8H15BrO2. Molecular weight about 223.11 g·mol⁻¹.

What is the CAS number of Ethyl 2-bromohexanoate?

The CAS Registry Number for Ethyl 2-bromohexanoate is 615-96-3.

Run AI retrosynthesis for Ethyl 2-bromohexanoate Target catalog AI tools overview

Start from this SMILES and explore AI retrosynthesis routes for C8H15BrO2.

Related targets

Similar compounds

Diethyl bromomethylmalonate 1-Chloroethyl Cyclohexyl Carbonate 4-Chlorobutyl acetate Chloromethyl pivalate Diethyl hexafluoroglutarate Hexafluoroisopropyl acrylate

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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.