4-Methyl-2-pentanone (C6H12O)

4-Methyl-2-pentanone presents a C6 framework (formula C6H12O, CAS 108-10-1). ChemicalTool Reaction can propose ranked disconnections for 4-Methyl-2-pentanone from the SMILES CC(=O)CC(C)C.

Target: 4-Methyl-2-pentanone
CAS: 108-10-1
Formula: C6H12O
Approx. MW: 100.16
SMILES: CC(=O)CC(C)C
PubChem CID: 7909
Approx. carbons: C6

4-Methyl-2-pentanone structure

Properties

Molecular weight: 100.16

View on PubChem

4-Methyl-2-pentanone 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 4-Methyl-2-pentanone?

4-Methyl-2-pentanone has molecular formula C6H12O. Molecular weight about 100.16 g·mol⁻¹.

What is the CAS number of 4-Methyl-2-pentanone?

The CAS Registry Number for 4-Methyl-2-pentanone is 108-10-1.

Run AI retrosynthesis for 4-Methyl-2-pentanone Target catalog AI tools overview

Start from this SMILES and explore AI retrosynthesis routes for C6H12O.

Related targets

Similar compounds

1-Hexen-3-Ol 2-Ethylbutanal 2-Methylpentanal 3-Methyl-2-pentanone Cyclohexanol Pinacolone

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.