Acetophenone
Also known as 1-Phenylethanone, Methyl phenyl ketone, Phenyl methyl ketone
Key facts
What buyers check first
- Appearance
- Colorless liquid
- Melting point
- 19.4 °C
- Boiling point
- 202.1 °C
- Density
- 1.0281 g/cm³ at 20 °C
- Flash point
- 76 °C
- HS code
- 291439
- Category
- Synthetic aroma chemicals
- UN number
- UN 1993

What is Acetophenone?
Plain description, key identifiers and synonyms
Acetophenone is a methyl ketone that is acetone in which one of the methyl groups has been replaced by a phenyl group. It has a role as a xenobiotic, a photosensitizing agent and an animal metabolite.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- 1-phenylethanone
- CAS number
- 98-86-2 CAS number cross-checked
- EC number
- 202-708-7
- Molecular formula
- C8H8O
- UNII
- RK493WHV10
- MDL number
- MFCD00008724
- INCI name
- ACETOPHENONE
- InChIKey
- KWOLFJPFCHCOCG-UHFFFAOYSA-N
- InChI
- InChI=1S/C8H8O/c1-7(9)8-5-3-2-4-6-8/h2-6H,1H3
- SMILES (canonical and isomeric)
- CC(=O)C1=CC=CC=C1
Synonyms
- 1-Phenylethanone
- Methyl phenyl ketone
- Phenyl methyl ketone
- Acetylbenzene
- Hypnone
- Ethanone, 1-phenyl-
- Benzoyl methide
- Acetophenon
- 1-phenylethan-1-one
- Acetylbenzol
- 1-Phenyl-1-ethanone
- Benzoylmethide
- Acetofenon
- Benzene, acetyl-
- USAF EK-496
- Ketone, methyl phenyl
- 1-phenyl-ethanone
- Phenylethanone
- RCRA waste number U004
- Hypnon
- methylphenylketone
- phenylmethylketone
- acetyl-benzen
- Dymex
- Acetophenone-alpha-13C
Show all 37 synonymsShow fewer synonyms
- RCRA waste no. U004
- Ketone, methyl phenyl-
- (2,2,2,-2H3)acetophenone
- aceto phenone
- aceto-phenone
- Acetyl-Benzene
- 6-acetophenone
- alpha-Acetophenone
- Ethanone,1-phenyl
- methyl-phenyl ketone
- Methyl phenyl-Ketone
- nchem.180-comp5
Physical and chemical properties
Measured values and descriptors computed from the structure
Physical and chemical properties
Measured values, check the supplier specification for your grade
| Appearance | Colorless liquidexp.Measured value |
|---|---|
| Odour | Sweet pungent odorexp.Measured value |
| Taste | Sweet, pungent tasteexp.Measured value |
| Melting point | 19.4 °Cexp.Measured value |
| Boiling point | 202.1 °Cexp.Measured value |
| Density | 1.0281 g/cm³ at 20 °Cexp.Measured value |
| Flash point | 76 °Cexp.Measured value |
| Autoignition temperature | 570 °Cexp.Measured value |
| Solubility | In water, 6,130 mg/L at 25 °Cexp.Measured value |
| Vapour pressure | 0.397 mm Hg at 25 °Cexp.Measured value |
Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.
Computed descriptors
Calculated from the structure, useful for screening and formulation
| Molecular weight | 120.15 g/molcalc.Computed value |
|---|---|
| Exact mass | 120.0575 Dacalc.Computed value |
| LogP (octanol/water) | 1.89calc.Computed value |
| Topological polar surface area | 17.07 Ųcalc.Computed value |
| Hydrogen bond donors | 0calc.Computed value |
| Hydrogen bond acceptors | 1calc.Computed value |
| Rotatable bonds | 1calc.Computed value |
| Heavy atoms | 9calc.Computed value |
| Rings | 1calc.Computed value |
| Aromatic rings | 1calc.Computed value |
| Fraction sp3 carbons | 0.13calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 0calc.Computed value |
| Lipinski rule of five | Passes (0 violations)calc.Computed value |
Calculated for screening. Confirm critical figures with the supplier.
Murcko scaffold
The ring system that remains when every side chain is removed
Safety and hazards
GHS classification summary, not a safety data sheet
Hazard statements
- H302Harmful if swallowed.
- H319Causes serious eye irritation.
Precautionary statements (9)
- P264Wash skin thoroughly after handling.
- P264 + P265Wash skin thoroughly after handling. Do not touch eyes.
- P270Do not eat, drink or smoke when using this product.
- P280Wear protective gloves, protective clothing, eye protection and face protection.
- P301 + P317If swallowed: Get medical help.
- P305 + P351 + P338If in eyes: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
- P330Rinse mouth.
- P337 + P317If eye irritation persists: Get medical help.
- P501Dispose of contents and container in accordance with local regulations.
- UN number
- UN 1993
GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.
Full safety data and first aidAcetophenone suppliers
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Where suppliers are based
153 suppliers in 20 countries
- China50
- United States34
- India29
- Germany5
- France3
- United Kingdom3
- and 14 more countries
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Acetophenone price
Indicative price range per kg from live supplier offers
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Uses and applications
What the substance is used for, by industry and function
Photosensitizing Agents.
In perfumery to impart an orange-blossom-like odor, catalyst for the polymerization of olefins, in organic syntheses, esp. as photosensitizer.
It is useful in flavors of grape, cherry and tobacco.
Acetophenone is used in perfumery as a fragrance ingredient in soaps, detergents, creams, lotions, and perfumes, as a flavoring agent in foods, nonalcoholic beverages, and tobacco, as a specialty solvent for plastics and resins, as a catalyst for the polymerization of olefins, and in organic syntheses as a photosensitizer.
Industrial uses: Solvent, Processing aids not otherwise specified, Intermediate.
Consumer uses: Intermediate, Fragrance.
Industries and functions
- Fragrance ingredients in cosmetics and personal care
- Solvents in paints and coatings
- Flavors in food and beverage
- Solvents in adhesives and sealants
- Fragrances in home care and cleaning
- Flavoring agents in flavors and fragrances
- Fragrance ingredients in flavors and fragrances
- Aldehydes and ketones in flavors and fragrances
Cosmetic ingredient, INCI name ACETOPHENONE(fragrance, perfuming)
Pharmacological actions
- Photosensitizing Agents
Roles
- animal metabolite
- eukaryotic metabolite
- metabolite
- pharmaceutical
- photosensitizing agent
- xenobiotic
Functional uses
- Deodorizer
- Flavouring and nutrient
- Fragrance
- Solvent
Cosmetic functions
- Fragrance
- Perfuming
How it is made
By-product from the oxidation of cumene.
Made from benzene and acetylchloride in presence of aluminum chloride, catalytically from acetic and benzoic acids. Preparation from benzene and acetic anhydride...
By catalytic oxidation of ethyl benzene, also prepared by fractional distillation and crystallization from the essential oil of Stirlingia latifolia.
Regulatory status
Inventories, regulations and trade controls that list this substance
Europe
- EU harmonised classification (CLP Annex VI)Index no: 606-042-00-1
Health and food
- EU cosmetic ingredient inventory
United States
- TSCA inventory (USA)Status: Active in US commerce, Regulatory flags: Proposed section 4 test rule
HS code and trade data
Customs classification and reported world trade statistics
Global trade
World import and export statistics for the HS code Acetophenone is traded under.
Aromatic ketones without other oxygen function, other
- India * partner reported11.9%
- Germany9.9%
- United States8.7%
* Partner reported figures, a lower bound.
The HS code shown for Acetophenone is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Acetophenone, based on the data on this page
What is Acetophenone?
What is the CAS number of Acetophenone?
What is the molecular formula and weight of Acetophenone?
What is Acetophenone used for?
Is Acetophenone hazardous?
What is the HS code of Acetophenone?
Where can I buy Acetophenone?
Where can I buy Acetophenone in India?
What is the price of Acetophenone?
Guides for buyers
Practical guides that help when you source, ship or handle Acetophenone
- Guide, SafetyHow to read a safety data sheet in 10 minutesA section by section method to pull the essentials out of any 16 section SDS: identity, hazards, composition, storage, PPE, properties, transport and emergency measures.Read
- Guide, Trade and logisticsShipping dangerous goods: UN numbers, classes and packing groupsHow the UN dangerous goods system works for chemicals, from the nine classes and UN numbers to packing groups, UN packaging marks, labels, documents and segregation.Read
- Guide, SafetyGHS pictograms, signal words and hazard statements explainedA practical guide to the nine GHS pictograms, the signal words Danger and Warning, H and P statements, and how to read a chemical label in seconds.Read
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