Methyl 5-bromovalerate (C6H11BrO2)

Looking for routes to Methyl 5-bromovalerate? Methyl 5-bromovalerate presents a C6 framework, halogen substitution. Use the planner with prefilled SMILES, or copy COC(=O)CCCCBr (CAS 5454-83-1).

Target: Methyl 5-bromovalerate
CAS: 5454-83-1
Formula: C6H11BrO2
Approx. MW: 195.06
SMILES: COC(=O)CCCCBr
PubChem CID: 79557
Approx. carbons: C6

Methyl 5-bromovalerate structure

Properties

Molecular weight: 195.06

View on PubChem

Methyl 5-bromovalerate 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of Methyl 5-bromovalerate?

Methyl 5-bromovalerate has molecular formula C6H11BrO2. Molecular weight about 195.06 g·mol⁻¹.

What is the CAS number of Methyl 5-bromovalerate?

The CAS Registry Number for Methyl 5-bromovalerate is 5454-83-1.

Run AI retrosynthesis for Methyl 5-bromovalerate Target catalog AI tools overview

Open the planner with Methyl 5-bromovalerate preloaded, then keep routes that match CAS 5454-83-1.

Related targets

Similar compounds

Ethyl 2-bromoisobutyrate Ethyl 4-bromobutyrate tert-Butyl bromoacetate 1-Bromo-2-ethylbutane 1-Bromo-6-chlorohexane 1-Bromohexane

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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.