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Chemical substance record

Eugenol

97-53-0C10H12O2164.204 g/mol

A phenylpropanoid formally derived from guaiacol with an allyl chain substituted para to the hydroxy group. It is a major component of clove essential oil, and exhibits antibacterial, analgesic and antioxidant properties. It has been widely used in dentistry to treat toothache and pulpitis. — ChEBI

Safety references

Safety documents & references

1 indexed references
JP · NITE

Government GHS classification

R07-B-017-JNIOSH, MOE · FY2025

View classification

Find a product-specific SDS

Safety guides and government classification records are not a manufacturer’s SDS. Match supplier, product number, concentration, physical form, region and revision before using a document.

Identity & molecular properties

Source-linked values
CAS number97-53-0ChEBI ↗
Molecular formulaC10H12O2ChEBI ↗
Molar mass164.204 g/molChEBI ↗
Monoisotopic mass164.08373 DaChEBI ↗
Formal charge0ChEBI ↗
ChEBI identifierCHEBI:4917ChEBI ↗

Cross-source molecular data

PubChem
Molar mass164.20 g/molPubChem ↗
Exact mass164.083729621 DaPubChem ↗
Computed XLogP2PubChem ↗
Topological polar surface area (Ų)29.5PubChem ↗
H-bond donors1PubChem ↗
H-bond acceptors2PubChem ↗
Rotatable bonds3PubChem ↗

PubChem computed values are shown separately from the ChEBI record. An exact InChIKey match was used to connect the records. Molecular descriptors do not describe a supplied product’s purity, particle size or performance.

Names & structural identifiers

Copy any identifier
eugenol
2-methoxy-4-(prop-2-en-1-yl)phenol
RRAFCDWBNXTKKO-UHFFFAOYSA-N
C=CCc1ccc(O)c(OC)c1
InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3

Names & synonyms

2-methoxy-4-(prop-2-en-1-yl)phenol

Names are supplied by ChEBI. Trade names and related synonyms may describe a broader product context.

Classification & relationships

ChEBI ontology

Roles recorded in ChEBI

sensitiservolatile oil componentantibacterial agentanalgesicantineoplastic agentflavouring agentEC 1.4.3.4 (monoamine oxidase) inhibitorvoltage-gated sodium channel blockeranaestheticradical scavenger

Database role annotations describe reported biological or chemical roles; they are not product approvals or recommendations for use.

Safety classification · Japan

NITE / Japanese government
Japan · FY2025 source classification
Eugenol · R07-B-017-JNIOSH, MOE
EndpointReported classification
Serious eye damage/eye irritationCategory 2A
Skin sensitizationCategory 1A
CarcinogenicityCategory 2
Specific target organ toxicity - Single exposureCategory 3 (Narcotic effects)
Hazardous to the aquatic environment (Acute)Category 2
Hazardous to the aquatic environment (Long-term)Category 3

Selected source-reported endpoints. Other endpoints, rationales and conditions remain in the original classification. Missing or unlisted information does not mean non-hazardous. This is not a global classification or transport decision.

Read the original NITE classification

Mass ↔ amount of substance

Calculated from sourced mass
Equivalent amount
0.00608999 mol

Uses 164.204 g/mol from ChEBI. Assumes the substance described by this record; no purity or concentration correction is applied.

Elemental composition

Theoretical mass fractions
C
Carbon · 10 atoms
73.15%
O
Oxygen · 2 atoms
19.49%
H
Hydrogen · 12 atoms
7.37%

Calculated theoretical mass fractions from the reported formula and PubChem periodic-table atomic masses. These are not assay or purity results.

Research & patent references

Selected source associations
In vitro human T cell sensitization to haptens by monocyte-derived dendritic cells. ↗Toxicology in vitro : an international journal published in association with BIBRA · 2000 Dec · PMID 11033063
Comparative effects of eugenol to bis-eugenol on oral mucous membranes. ↗Dental materials journal · 2001 Sep · PMID 11806158

Sources & record history

Checked 27 Sep 2026
EMBL-EBI ChEBI · CHEBI:4917

Release 255, 9 September 2026. ChEBI three-star (manually annotated) source entry. View original record ↗ · CC BY 4.0

NCBI PubChem · CID 3314 · retrieved 2026-09-27

PubCAS formats source data, connects references and computes explicitly labelled conversions. CAS cross-references are supplied by ChEBI; they do not constitute CAS verification or endorsement.