Anisole is a monomethoxybenzene that is benzene substituted by a methoxy group.
Definition
Anisole is a monomethoxybenzene that is benzene substituted by a methoxy group. It has a role as a plant metabolite.
Source: PubChem
US FDA substance register · UNII B3W693GAZH · registered name Anisole · single chemical substance
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
Names & identifiers
- CAS No.chemical registry number
- 100-66-3
- EC No.EU chemical inventory number
- 202-876-1
- DTXSIDUS EPA chemical ID
- DTXSID4041608
- DTXCIDUS EPA compound ID
- DTXCID2021608
- IUPAC
- Anisole
- Molecular formula
- C7H8O
- Molecular weight
- 108.14 g/mol
Measured properties
- Appearance
- Anisole appears as a clear straw-colored liquid with an aromatic odor. Insoluble in water and the same density as water. Vapors heavier than air. Moderately toxic by ingestion. A skin irritant. Used to make perfumes, flavorings and as a solvent. · Liquid
- Odour
- SWEET ANISE-LIKE ODOR · Agreeable aromatic odor
- Boiling point
- 155.5 °C AT 760 MM HG · 153.00 to 155.00 °C. @ 760.00 mm Hg
- Melting point
- -37.3 °C · -37.5 °C
- Solubility
- SOLUBLE IN ALCOHOL AND ETHER · VERY SOLUBLE IN ACETONE
- Density
- 0.9956 AT 18 °C/4 °C · PER CENT IN SATURATED AIR: 0.41, DENSITY OF SATURATED AIR: 1.1 (AIR= 1)
- Viscosity
- 1.52 centipoise at 15 °C, 0.778 centipoise at 30 °C
- Melting/freezing point
- -38.5 ℃
- Initial boiling point and range
- 155 ℃
- Flash point
- 52 ℃(o.c.)
- Vapour pressure
- 0.47 ㎪ (at 25 C)
- Vapour density
- 3.7 ()
- Relative density
- 0.9961 ()
- n-Octanol/water partition coefficient (Kow)
- 2.11
- Auto-ignition temperature
- 475 ℃
- Molecular weight
- 108.14
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 5 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.
- Fragrance2
- Flavouring and nutrient2
- Solvent1
Source: US EPA CompTox dashboard
Irritation and sensitisation studies
5 skin studies and 3 eye studies are on record.
The studies disagree (the most common conclusion covers 50%), 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 8 studies
- Not likely to be sensitizing
skin sensitisation: in vivo (non-LLNA) · Screening · according to OECD Guideline 406 (Skin Sensitisation) - Moderate or Mild Irritation
skin irritation: in vivo · Screening · OECD Guideline 404 (Acute Dermal Irritation / Corrosion) according to EU Method B.4 (Acute Toxicity: Dermal Irritation / Corrosion) according to - Category 6.3B (Category 3)
Skin Irritation · Read Across - Classification not possible
Skin Irritation · Screening - Classification not possible
Skin Sensitization · Screening - Studies Indicate No Significant Irritation
eye irritation: in vivo · Screening · OECD Guideline 405 (Acute Eye Irritation / Corrosion) according to EU Method B.5 (Acute Toxicity: Eye Irritation / Corrosion) according to - Classification not possible
Eye Irritation · Screening - Category 6.4A (Category 2A)
Eye Irritation · Read Across
Source: US EPA CompTox dashboard
Related literature
- Storage stable tretinoin and 4-hydroxy anisole containing topical composition · 2001
- Exploring the Therapeutic Effects of Anisole on Psoriasis in Mice Based on the JAK1/STAT3 Pathway · 2025
- A fast and reliable method to quantify neral and geranial (citral) in essential oils using 1H NMR spectroscopy · 2023
- Novel Application of Natural Anisole Compounds as Enhancers for Transdermal Delivery of Ligustrazine. · 2015
- Scientific Opinion on the safety and efficacy of aromatic ethers including anisole derivatives (chemical group 26) when used as feed additives for all animal species. · 2012
Linked databases 16
- Australian Industrial Chemicals Inventory (AICIS)
- ChEBI
- ChEMBL
- EU CosIng ingredient list 2
- 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