4-tert-Butylanisole (C11H16O)

4-tert-Butylanisole presents a C11 framework, aromatic rings (formula C11H16O, CAS 5396-38-3). ChemicalTool Reaction can propose ranked disconnections for 4-tert-Butylanisole from the SMILES COc1ccc(C(C)(C)C)cc1.

Target: 4-tert-Butylanisole
CAS: 5396-38-3
Formula: C11H16O
Approx. MW: 164.25
SMILES: COc1ccc(C(C)(C)C)cc1
PubChem CID: 94750
Approx. carbons: C11

4-tert-Butylanisole structure

Properties

Molecular weight: 164.25

View on PubChem

4-tert-Butylanisole 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 4-tert-Butylanisole?

4-tert-Butylanisole has molecular formula C11H16O. Molecular weight about 164.25 g·mol⁻¹.

What is the CAS number of 4-tert-Butylanisole?

The CAS Registry Number for 4-tert-Butylanisole is 5396-38-3.

Run AI retrosynthesis for 4-tert-Butylanisole Target catalog AI tools overview

Start from this SMILES and explore AI retrosynthesis routes for C11H16O.

Related targets

Similar compounds

1-(tert-Butoxy)-4-methylbenzene 1-(4-Methylphenyl)-1H-pyrrole 1-Benzylpyrrole 1-Methylnaphthalene 1-Naphthaldehyde 1-Naphthalenemethanol

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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.