tert-Butyl 2-bromopropanoate (C7H13BrO2)

Looking for routes to tert-Butyl 2-bromopropanoate? tert-Butyl 2-bromopropanoate presents a C7 framework, an ester, halogen substitution. Use the planner with prefilled SMILES, or copy CC(Br)C(=O)OC(C)(C)C (CAS 39149-80-9).

Target: tert-Butyl 2-bromopropanoate
CAS: 39149-80-9
Formula: C7H13BrO2
Approx. MW: 209.08
SMILES: CC(Br)C(=O)OC(C)(C)C
PubChem CID: 545327
Approx. carbons: C7

tert-Butyl 2-bromopropanoate structure

Properties

Molecular weight: 209.08

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tert-Butyl 2-bromopropanoate 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of tert-Butyl 2-bromopropanoate?

tert-Butyl 2-bromopropanoate has molecular formula C7H13BrO2. Molecular weight about 209.08 g·mol⁻¹.

What is the CAS number of tert-Butyl 2-bromopropanoate?

The CAS Registry Number for tert-Butyl 2-bromopropanoate is 39149-80-9.

Run AI retrosynthesis for tert-Butyl 2-bromopropanoate Target catalog AI tools overview

Start from this SMILES and explore AI retrosynthesis routes for C7H13BrO2.

Related targets

Similar compounds

1-Chloroethyl Cyclohexyl Carbonate 4-Chlorobutyl acetate Bis(2-chloroethyl) carbonate Chloromethyl pivalate Diethyl bromomethylmalonate Diethyl hexafluoroglutarate

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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.