2-Methyl-4-heptanone (C8H16O)

Looking for routes to 2-Methyl-4-heptanone? 2-Methyl-4-heptanone presents a C8 framework. Use the planner with prefilled SMILES, or copy CCCC(=O)CC(C)C (CAS 626-33-5).

Target: 2-Methyl-4-heptanone
CAS: 626-33-5
Formula: C8H16O
Approx. MW: 128.22
SMILES: CCCC(=O)CC(C)C
PubChem CID: 69378
Approx. carbons: C8

2-Methyl-4-heptanone structure

Properties

Molecular weight: 128.22

View on PubChem

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

FAQ

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

2-Methyl-4-heptanone has molecular formula C8H16O. Molecular weight about 128.22 g·mol⁻¹.

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

The CAS Registry Number for 2-Methyl-4-heptanone is 626-33-5.

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

One click loads 2-Methyl-4-heptanone into ChemicalHelper Reaction for route exploration.

Related targets

Similar compounds

2-Cyclohexylethanol 2-Hexyloxirane 2-Methyl-3-Heptanone 2-Octanone 5-Methylheptan-3-one 6-Methylheptan-2-one

Browse the full target catalog

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.