Methyl cyclohexylacetate (C9H16O2)

Methyl cyclohexylacetate presents a C9 framework (formula C9H16O2, CAS 14352-61-5). ChemicalHelper Reaction can propose ranked disconnections for Methyl cyclohexylacetate from the SMILES COC(=O)CC1CCCCC1.

Target: Methyl cyclohexylacetate
CAS: 14352-61-5
Formula: C9H16O2
Approx. MW: 156.23
SMILES: COC(=O)CC1CCCCC1
PubChem CID: 139743
Approx. carbons: C9

Methyl cyclohexylacetate structure

Properties

IUPAC name: methyl 2-cyclohexylacetate
Common names: 14352-61-5; Methyl cyclohexylacetate; Cyclohexaneacetic acid, methyl ester; EC 700-789-8; RefChem:580497; 700-789-8; methyl 2-cyclohexylacetate; Methylcyclohexylacetate; Methyl cyclohexaneacetate; NSC-68511
Molecular weight: 156.22
Exact mass: 156.12
InChIKey: IMXBRVLCKXGWSS-UHFFFAOYSA-N

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Methyl cyclohexylacetate 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of Methyl cyclohexylacetate?

Methyl cyclohexylacetate has molecular formula C9H16O2. Molecular weight about 156.23 g·mol⁻¹.

What is the CAS number of Methyl cyclohexylacetate?

The CAS Registry Number for Methyl cyclohexylacetate is 14352-61-5.

Run AI retrosynthesis for Methyl cyclohexylacetate Target catalog AI tools overview

Start from this SMILES and explore AI retrosynthesis routes for C9H16O2.

Related targets

Similar compounds

Allyl hexanoate Cyclohexyl Propionate Gamma-nonalactone

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References & tools

ChemicalHelper Reaction — AI retrosynthesis with optional library evidence.
PubChem — compound identifiers and structure depictions (NIH/NCBI).
Related: AiZynthFinder / synthesis planning literature for computer-aided retrosynthesis.