Ethyl methacrylate (CAS 97-63-2) — Citrus Top Note Fragrance Ingredient
Ethyl methacrylate
CAS 97-63-2
What Is Ethyl methacrylate?
Ethyl methacrylate is a synthetic compound primarily used in industrial applications like plastics and adhesives. Most consumers encounter it in acrylic nails or dental materials. In perfumery, it’s a niche ingredient that provides sharp, fruity-ester notes when used in trace amounts.
Safety Profile
PROFESSIONAL USEWhat Does Ethyl methacrylate Smell Like?
Ethyl methacrylate delivers an intensely sharp, fruity ester character reminiscent of unripe pineapple or green apple skins with a vinyl-like edge. The top note is piercingly bright, evolving into a synthetic fruitiness that lacks natural roundness. In dry-down, it leaves a faint plasticky residue. Best used in micro-doses to add modern, industrial fruit facets to avant-garde compositions.
In Famous Fragrances
Fragrance associations may not reflect actual formulations.
Used minimally to amplify the hyper-realistic green apple effect, contributing to the fragrance’s artificial nature theme.
2D Molecular Structure
SMILES: CCOC(=O)C(C)=C
Chemistry, Properties & Perfumer Guide
The Chemistry
Ethyl methacrylate is an ester of methacrylic acid, belonging to the acrylate family. Industrially produced via esterification of methacrylic acid with ethanol. The molecule’s reactivity comes from its conjugated double bond system, making it valuable for polymerization. In perfumery, the monomeric form is used at very low concentrations due to its potency and potential sensitization.
Physical & Chemical Properties
| Boiling Point | 118-119 °C |
|---|---|
| Flash Point | 20 °C |
| Density | 0.913 g/cm³ |
Perfumer Guide
| Application | Typical % | Range | Notes |
|---|---|---|---|
| Fine Fragrance | 0.01-0.1% | Max 0.5% | Extreme caution required |
| Functional Fragrance | Not used | Not used | Avoid due to sensitization risk |
Classic Accords
Tip: Always dissolve in ethanol first before adding to main composition to ensure even distribution.
Alternatives & Comparisons
Less reactive alternative with similar fruity character but lower sensitization potential. Still requires caution.
Safety, Regulatory & Sustainability
⚠ Regulatory Disclaimer
General reference only. Consult current IFRA Standards Library before formulating.
IFRA Status
Not specifically restricted by IFRA but falls under general acrylate restrictions (Amendment 49).
EU Allergen Declaration
Not currently listed as EU allergen but may require declaration due to sensitization potential.
GHS Classification
RIFM Assessment
RIFM classifies as moderate sensitizer; not recommended for leave-on products.
Sustainability
Petrochemical-derived with significant environmental impact during production. Not biodegradable. Synthetic alternatives exist but share similar ecological concerns. Closed-loop manufacturing is recommended for industrial use.
Explore Ethyl methacrylate
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References
- IFRA Standards (Amendment 49). Acrylate restrictions. IFRA
- ECHA Substance Information. Ethyl methacrylate. ECHA
Data: PubChem (NIH), PubMed, RIFM, IFRA. Last reviewed: Apr 2026.
Report a data errorIngredient Data Sheet
CAS 97-63-2Physical Properties
| Molecular Weight | 114.14 g/mol🔬 PubChem |
| LogP (Octanol-Water) | 1.9🔬 PubChem |
| Boiling Point | 117.2 °C🔬 EPA CompTox |
| Vapor Pressure | 14 mmHg @ 25°C📊 OPERA |
| Flash Point | 15.6 °C🔬 EPA CompTox |
| Involatility Index | 1.4123💻 Calculated |
| log Kp (skin permeability) | -2.047💻 Calculated |
| SMILES | CCOC(=O)C(=C)C🔬 PubChem |
Volatility & Performance
| Fragrance Note | Top💻 Calculated |
| Volatility Class | Fast💻 Calculated |
| Persistence Score | 0.5 / 5💻 Calculated |
Odor & Flavor
| Primary Descriptors | applepungent• leffingwell |
| Functional Groups | esteretheralkene💻 RDKit |
| “Very diffusive and penetrating, gassy-herbaceous, warm odor of very poor tenacity.”📖 Arctander | |
Sensory Thresholds
| Odor Detection Threshold | 0.0171 ppm (n=3)📖 van Gemert |
Physical data: PubChem (NIH/NLM), U.S. EPA CompTox Dashboard, EPA OPERA models, RDKit. Odor & flavor: Arctander (Perfume & Flavor Chemicals), Fenaroli's Handbook of Flavor Ingredients, Leffingwell. Thresholds: van Gemert (Compilations of Odour Threshold Values). Regulatory: IFRA Standards 51st, FEMA GRAS. Trade names: Surburg (Common Fragrance & Flavor Materials). All data compiled and cross-referenced for perfumertools.com.
Physicochemical Properties
DTXSID: DTXSID1025308
Physical Properties
| Molecular Weight | 114.144 g/mol🔬 EPA CompTox |
| Density | 0.913 g/cm^3🔬 EPA CTX |
| Boiling Point | 117.324 °C🔬 EPA CTX |
| Melting Point | -70.313 °C🔬 EPA CTX |
| Flash Point | 20.047 °C🔬 EPA CTX |
| Refractive Index | 1.41 Dimensionless📊 OPERA |
| Molar Volume | 125.953 cm^3/mol📊 OPERA |
Partition & Solubility
| LogP (Octanol-Water) | 1.832 Log10 unitless🔬 EPA CTX |
| LogD (pH 5.5) | 1.903 Log10 unitless📊 OPERA |
| LogD (pH 7.4) | 1.903 Log10 unitless📊 OPERA |
| LogKoa (Octanol-Air) | 3.7 Log10 unitless📊 OPERA |
| Water Solubility | 0.049 mol/L🔬 EPA CTX |
| Henry's Law Constant | 0.001 atm-m3/mole🔬 EPA CTX |
Transport Properties
| Vapor Pressure | 20.655 mmHg🔬 EPA CTX |
| Surface Tension | 24.697 dyn/cm📊 OPERA |
| Thermal Conductivity | 137.289 mW/(m*K)📊 OPERA |
Molecular Descriptors
| Topological Polar Surface Area | 26.3 Ų💻 Computed |
| H-Bond Donors | 0 count💻 Computed |
| H-Bond Acceptors | 2 count💻 Computed |
| Rotatable Bonds | 2 count💻 Computed |
| Aromatic Rings | 0 count💻 Computed |
| Molar Refractivity | 31.189 cm^3/mol📊 OPERA |
| Polarizability | 12.364 Å^3📊 OPERA |
Data Sources:
🔬 EPA Experimental data from U.S. EPA CompTox Chemicals Dashboard & CTX APIs. 📊 OPERA Predicted using EPA's OPERA QSAR models. 💻 Computed Calculated from SMILES using RDKit.
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