Acetophenone is a methyl ketone that is acetone in which one of the methyl groups has been replaced by a phenyl group.
Definition
Acetophenone is a methyl ketone that is acetone in which one of the methyl groups has been replaced by a phenyl group.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.
Source: PubChem
US FDA substance register · UNII RK493WHV10 · registered name Acetophenone · single chemical substance
Acetophenone is the organic compound that conforms to the formula:
Cosmetic roles
Safety & regulatory references
Not classified under Korea’s toxic-substance GHS list · existing chemical substance
More data — names, identifiers, properties, test records, literature
Official labels & definitions
JCIA labelling name アセトフェノン: 本品は、次の化学式で表される有機化合物である。
Source: JCIA labelling names (Japan)
Names & identifiers
- CAS No.chemical registry number
- 98-86-2
- EC No.EU chemical inventory number
- 202-708-7
- DTXSIDUS EPA chemical ID
- DTXSID6021828
- DTXCIDUS EPA compound ID
- DTXCID501828
- IUPAC
- 1-Phenylethan-1-one
- Molecular formula
- C8H8O
- Molecular weight
- 120.151 g/mol
Measured properties
- Appearance
- Acetophenone appears as a colorless liquid with a sweet pungent taste and odor resembling the odor of oranges. Freezes under cool conditions. Slightly soluble in water and denser than water. Hence sinks in water. Vapor heavier than air. A mild irritant to skin and eyes. Vapors can be narcotic in high concentrations. Used as a flavoring, solvent, and polymerization catalyst. · CBI, Liquid
- Odour
- Sweet pungent odor · Sweet, pungent and strong medicinal odor
- Boiling point
- 395.1 °F at 760 mmHg (USCG, 1999) · 202.1 °C
- Melting point
- 67.5 °F (USCG, 1999) · 19.4 °C
- Solubility
- In water, 6,130 mg/L at 25 °C · Slightly soluble in water
- Density
- 1.028 at 68 °F (USCG, 1999) - Denser than water, will sink · 1.0281 g/cu cm at 20 °C
- Odour threshold
- 0.3 ppm
- Melting/freezing point
- 20 ℃
- Initial boiling point and range
- 202 ℃
- Flash point
- 77 ℃(c.c.)
- Vapour pressure
- 0.133 ㎪(15℃)
- Water solubility
- 0.613 g/100㎖(25℃)
- Vapour density
- 4.1
- Relative density
- 1.03
- n-Octanol/water partition coefficient (Kow)
- 1.58
- Auto-ignition temperature
- 571 ℃
- Viscosity
- 0.93 cP(20℃)
- Molecular weight
- 120.1
Values measured on the substance itself. The KOSHA data are a reference for writing and reviewing safety data sheets, not a specification for a commercial raw material.
Source: PubChem · KOSHA safety data sheets (Korea)
What products actually use it for
What the 80 products reported to the US EPA with this ingredient use it for. Products outside cosmetics are included, so the top few rows are its main uses.
- Fragrance63
- Flavouring and nutrient6
- Intermediate3
- Solvent2
- Adsorbent2
- Processing aids not otherwise specified1
- Corrosion inhibitor1
- No specific technical function1
1 other uses
- Deodorizer1
Source: US EPA CompTox dashboard
Irritation and sensitisation studies
5 skin studies and 5 eye studies are on record.
The studies disagree (the most common conclusion covers 33%), so they do not establish that this ingredient is irritating. These tests are on the raw material itself; irritation at the amount in a finished product is a different question.
See all 10 studies
- Studies Indicate No Significant Irritation
skin irritation: in vivo · Screening · OECD Guideline 404 (Acute Dermal Irritation / Corrosion) equivalent or similar to other guideline: Consumer Product Safety Commission of the USA, Code of Federal Regulations, Title 16, Section 1500.41 according to - Studies Indicate No Significant Irritation
skin irritation: in vivo · Screening · OECD Guideline 404 (Acute Dermal Irritation / Corrosion) equivalent or similar to - Category 6.3A (Category 2)
Skin Irritation · Read Across - Classification not possible
Skin Sensitization · Screening - Category 2
Skin Irritation · Screening - Eye Irrit. 2
Eye Irritation · Authoritative - Studies Indicate No Significant Irritation
eye irritation: in vivo · Screening · OECD Guideline 405 (Acute Eye Irritation / Corrosion) equivalent or similar to other guideline: Consumer Product Safety Commission of the USA, Code of Federal Regulations, Title 16, Section 1500.42 according to - Studies Indicate No Significant Irritation
eye irritation: in vivo · Screening · OECD Guideline 405 (Acute Eye Irritation / Corrosion) equivalent or similar to - Category 2A
Eye Irritation · Screening - Category 6.4A (Category 2A)
Eye Irritation · Read Across
Source: US EPA CompTox dashboard
Related literature
- A Novel Molecule 3‐(1′‐Methyltetrahydropyridinyl)‐2,4‐6‐Trihydroxy Acetophenone Alleviates Ultraviolet‐B‐Induced Photoaging in Human Dermal Fibroblasts and BALB/c Mice · 2023
- Inhibition of melanogenesis by 3-(1'-methyltetrahydropyridinyl)-2,4-6-trihydroxy acetophenone via suppressing the activity of cAMP response element-binding protein (CREB) and nuclear exclusion of CREB-regulated transcription coactivator 1 (CRTC1). · 2023
- Sensitization properties of acetophenone azine, a new skin sensitizer identified in textile · 2022
- A volatile from the skin microbiota of flavivirus-infected hosts promotes mosquito attractiveness. · 2022
- Monosubstituted Acetophenone Thiosemicarbazones as Potent Inhibitors of Tyrosinase: Synthesis, Inhibitory Studies, and Molecular Docking · 2021
Linked databases 18
- Australian Industrial Chemicals Inventory (AICIS)
- ChEBI
- ChEMBL
- EU CosIng ingredient list 2
- EU SCCS safety opinions
- JCIA labelling names (Japan)
- Korea toxic substances GHS register (NIER)
- KOSHA safety data sheets (Korea)
- NIST Chemistry WebBook
- PubChem 2
- Tlooto literature search 2 3 4 5
- UniChem cross-reference IDs
- US EPA CompTox dashboard 2
- US EPA DSSTox chemical database
- US FDA substance registration (GSRS)
- US FDA Unique Ingredient Identifier (UNII)
- Wikidata
- Wikipedia · Korean · English · Japanese · Chinese