Acetone dimethyl acetal (C5H12O2)

Acetone dimethyl acetal presents a C5 framework (formula C5H12O2, CAS 77-76-9). ChemicalTool Reaction can propose ranked disconnections for Acetone dimethyl acetal from the SMILES COC(C)(C)OC.

Target: Acetone dimethyl acetal
CAS: 77-76-9
Formula: C5H12O2
Approx. MW: 104.15
SMILES: COC(C)(C)OC
PubChem CID: 6495
Approx. carbons: C5

Acetone dimethyl acetal structure

Properties

Molecular weight: 104.15

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Acetone dimethyl acetal 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of Acetone dimethyl acetal?

Acetone dimethyl acetal has molecular formula C5H12O2. Molecular weight about 104.15 g·mol⁻¹.

What is the CAS number of Acetone dimethyl acetal?

The CAS Registry Number for Acetone dimethyl acetal is 77-76-9.

Run AI retrosynthesis for Acetone dimethyl acetal Target catalog AI tools overview

Start from this SMILES and explore AI retrosynthesis routes for C5H12O2.

Related targets

Similar compounds

1-Methoxy-2-Butanol 3-Methoxybutan-1-ol Isopentyldiol Isopropylethanediol Neopentyl glycol Pentamethylene glycol

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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.