CAS number:78-59-1
Molecular Formula:
C9H14O
Molecular Weight:
138.21 g/mol
Brief Introduction:
Isophorone is an industrial chemical that appears as a colorless, transparent liquid with an odor similar to that of mint or camphene. It is slightly soluble in water and evaporates faster than water. It is mainly used as a solvent in certain printing inks, coatings, varnishes, and adhesives, and as an intermediate in the production of other specific chemicals. Although isophorone is an industrial chemical, it also occurs naturally in cranberries. Its boiling point is about 420°F, its flash point is close to 200°F, it irritates the skin and eyes upon contact, and is toxic if ingested. Long-term exposure may cause central nervous system effects such as dizziness, fatigue, and depression, and there are signs of fetal malformation and growth retardation in animal experiments. Isophorone has also been used to develop fluorescent probes, such as the ARP probe for in vivo hypoxia imaging, and the dual-response near-infrared fluorescent probe DHMH for detecting aluminum ions and pH changes. In addition, isophorone and its derivatives are also used in fragrances, polymer synthesis, environmental protection, and medical research. Its production is mainly carried out through the self-condensation reaction of acetone under base catalysis. The global annual output exceeds 100,000 tons, and the market is expected to grow further in the future.
Properities:
Molar Mass | 138.21 g/mol [1,2] |
Density (20°C) | 0.92 g/cm³ [2] |
Melting Point | -8.1°C [2] |
Boiling Point | 215°C [2] |
Physical State at Room Temperature | Colorless to yellowish liquid [2] |
Odor | Mint-like or camphor-like [2] |
Natural Occurrence | Found in saffron crocus, Mary's grass, cranberry, papaya, and as a pheromone in certain beetles [2] |
Solubility | Soluble in water, miscible with most organic solvents [2,3] |
Evaporation Rate | Higher than water [3] |
Applications | High-boiling-point solvent, starting material for various chemical processes (e.g., synthesis of isophorone diisocyanate, isophorone diamine) [1,2] |
Synthesis | Produced via base-catalyzed self-condensation of acetone [2] |
Market Value | USD 600 million for isophorone diamine (IPDA) in 2017, USD 700 million for isophorone diisocyanate (IPDI) in 2021 [2] |
References:
[1] "High Molar Mass Non-Isocyanate Polyurethanes by Transurethanization of Diols with Isophorone-Based Bismethylcarbamate" (2025)
[2] "The Production of Isophorone" (Encyclopedia 2023, 3(1), 224-244)
[3] "The Study of Exposure to Isophorone and the Risk of Getting Cancer: A Systematic Review and Meta-analysis Protocol" (Asian Pacific Journal of Environment and Cancer, Vol 6 No 1 2023)
Isophorone is a cyclic ketone, with a ketone functional group (C=O).
While isophorone itself is not aromatic, its structure includes a benzene ring as part of the cyclohexanone framework.
It is widely used as a solvent in coatings, paints, and adhesives due to its high solvency power.
Isophorone is used in the production of various resins and plasticizers.
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Chemtoo
Chemical Procurement Assistant