Phorone (C9H14O)

Phorone (C9H14O; CAS 504-20-1) is a practical retrosynthesis target. Phorone presents a C9 framework, unsaturation. Open AI route search in one click below.

Target: Phorone
CAS: 504-20-1
Formula: C9H14O
Approx. MW: 138.21
SMILES: CC(C)=CC(=O)C=C(C)C
PubChem CID: 10438
Approx. carbons: C9

Phorone structure

Properties

IUPAC name: 2,6-dimethylhepta-2,5-dien-4-one
Common names: 2,6-Dimethyl-2,5-heptadien-4-one; 504-20-1; PHORONE; 2,6-Dimethylhepta-2,5-dien-4-one; Diisopropylidene acetone; Foron; Diisobutenyl ketone; 2,5-Heptadien-4-one, 2,6-dimethyl-; Phoron; diisopropylideneacetone
Molecular weight: 138.21
Exact mass: 138.10
InChIKey: MTZWHHIREPJPTG-UHFFFAOYSA-N
Melting point: 28 °C
Boiling point: 198 °C
Density: Relative density (water = 1): 0.9

View on PubChem

Phorone 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of Phorone?

Phorone has molecular formula C9H14O. Molecular weight about 138.21 g·mol⁻¹.

What is the CAS number of Phorone?

The CAS Registry Number for Phorone is 504-20-1.

Run AI retrosynthesis for Phorone Target catalog AI tools overview

Open the planner with Phorone preloaded, then keep routes that match CAS 504-20-1.

Related targets

Similar compounds

4-Acetyl-1-methylcyclohexene Isophorone

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.