Methyl cyclohexanecarboxylate (C8H14O2)

Methyl cyclohexanecarboxylate (C8H14O2; CAS 4630-82-4) is a practical retrosynthesis target. Methyl cyclohexanecarboxylate presents a C8 framework. Open AI route search in one click below.

Target: Methyl cyclohexanecarboxylate
CAS: 4630-82-4
Formula: C8H14O2
Approx. MW: 142.20
SMILES: COC(=O)C1CCCCC1
PubChem CID: 20748
Approx. carbons: C8

Methyl cyclohexanecarboxylate structure

Properties

IUPAC name: methyl cyclohexanecarboxylate
Common names: Methyl cyclohexanecarboxylate; 4630-82-4; Methyl cyclohexanoate; Hexahydrobenzoic acid methyl ester; CYCLOHEXANECARBOXYLIC ACID, METHYL ESTER; Methyl cyclohexylcarboxylate; Methyl cyclohexylformate; Methyl hexahydrobenzoate; vanilla carboxylate; FEMA No. 3568
Molecular weight: 142.20
Exact mass: 142.10
InChIKey: ZQWPRMPSCMSAJU-UHFFFAOYSA-N
Boiling point: 183.00 °C. @ 760.00 mm Hg
Density: 0.990-0.999

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Methyl cyclohexanecarboxylate 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of Methyl cyclohexanecarboxylate?

Methyl cyclohexanecarboxylate has molecular formula C8H14O2. Molecular weight about 142.20 g·mol⁻¹.

What is the CAS number of Methyl cyclohexanecarboxylate?

The CAS Registry Number for Methyl cyclohexanecarboxylate is 4630-82-4.

Run AI retrosynthesis for Methyl cyclohexanecarboxylate Target catalog AI tools overview

One click loads Methyl cyclohexanecarboxylate into ChemicalTool Reaction for route exploration.

Related targets

Similar compounds

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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.