5-Methyl-2-Hexanone (C7H14O)

5-Methyl-2-Hexanone presents a C7 framework (formula C7H14O, CAS 110-12-3). ChemicalTool Reaction can propose ranked disconnections for 5-Methyl-2-Hexanone from the SMILES CC(=O)CCC(C)C.

Target: 5-Methyl-2-Hexanone
CAS: 110-12-3
Formula: C7H14O
Approx. MW: 114.19
SMILES: CC(=O)CCC(C)C
PubChem CID: 8034
Approx. carbons: C7

5-Methyl-2-Hexanone structure

Properties

Molecular weight: 114.19

View on PubChem

5-Methyl-2-Hexanone 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 5-Methyl-2-Hexanone?

5-Methyl-2-Hexanone has molecular formula C7H14O. Molecular weight about 114.19 g·mol⁻¹.

What is the CAS number of 5-Methyl-2-Hexanone?

The CAS Registry Number for 5-Methyl-2-Hexanone is 110-12-3.

Run AI retrosynthesis for 5-Methyl-2-Hexanone Target catalog AI tools overview

Open the planner with 5-Methyl-2-Hexanone preloaded, then keep routes that match CAS 110-12-3.

Related targets

Similar compounds

2-Pentyloxirane 4-Methylcyclohexanol Cycloheptanol Diisopropyl ketone hept-6-en-1-ol Heptanal

Browse the full target catalog

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.