Methyl 4-ethynylbenzoate (C10H8O2)

methyl 4-ethynylbenzoate presents a C10 framework, aromatic rings, an ester (formula C10H8O2, CAS 3034-86-4). ChemicalTool Reaction can propose ranked disconnections for methyl 4-ethynylbenzoate from the SMILES C#Cc1ccc(C(=O)OC)cc1.

Target: Methyl 4-ethynylbenzoate
CAS: 3034-86-4
Formula: C10H8O2
Approx. MW: 160.17
SMILES: C#Cc1ccc(C(=O)OC)cc1
PubChem CID: 640163
Approx. carbons: C10

Methyl 4-ethynylbenzoate structure

Properties

Molecular weight: 160.17

View on PubChem

Methyl 4-ethynylbenzoate 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of Methyl 4-ethynylbenzoate?

Methyl 4-ethynylbenzoate has molecular formula C10H8O2. Molecular weight about 160.17 g·mol⁻¹.

What is the CAS number of Methyl 4-ethynylbenzoate?

The CAS Registry Number for Methyl 4-ethynylbenzoate is 3034-86-4.

Run AI retrosynthesis for Methyl 4-ethynylbenzoate Target catalog AI tools overview

One click loads Methyl 4-ethynylbenzoate into ChemicalTool Reaction for route exploration.

Related targets

Similar compounds

2-(Diethylamino)ethyl methacrylate 3,5-xylenol methylcarbamate benzo[b]thiophen-3-yl acetate Catechol diacetate Cyclohexyl Methacrylate Diallyl succinate

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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.