Cyclohexanone (C6H10O)

Cyclohexanone (C6H10O; CAS 108-94-1) is a practical retrosynthesis target. Cyclohexanone presents a C6 framework. Open AI route search in one click below.

Target: Cyclohexanone
CAS: 108-94-1
Formula: C6H10O
Approx. MW: 98.15
SMILES: O=C1CCCCC1
PubChem CID: 7967
Approx. carbons: C6

Cyclohexanone structure

Properties

IUPAC name: cyclohexanone
Common names: CYCLOHEXANONE; 108-94-1; Ketohexamethylene; Pimelic ketone; Sextone; Nadone; Anone; Anon; Hytrol O; Cyclohexanon
Molecular weight: 98.14
Exact mass: 98.07
InChIKey: JHIVVAPYMSGYDF-UHFFFAOYSA-N
Melting point: 3 °F (NTP, 1992)
Boiling point: 312.1 °F at 760 mmHg (NTP, 1992)
Density: 0.945 at 68 °F (USCG, 1999) - Less dense than water; will float

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Cyclohexanone 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of Cyclohexanone?

Cyclohexanone has molecular formula C6H10O. Molecular weight about 98.15 g·mol⁻¹.

What is the CAS number of Cyclohexanone?

The CAS Registry Number for Cyclohexanone is 108-94-1.

Run AI retrosynthesis for Cyclohexanone Target catalog AI tools overview

Open the planner with Cyclohexanone preloaded, then keep routes that match CAS 108-94-1.

Related targets

Similar compounds

1-Hexyn-3-Ol 2-Cyclohexen-1-Ol 3-Methyl-1-pentyn-3-ol 5-Hexenal 5-Hexene-2-one 5-Hexyn-3-ol

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.