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Chemical substance record

2-pentylfuran

3777-69-3C9H14O138.21 g/mol

A member of the class of furans that is furan in which the hydrogen at position 2 is replaced by a pentyl group. It is found in many heat-processed foods and drinks. — ChEBI

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Identity & molecular properties

Source-linked values
CAS number3777-69-3ChEBI ↗
Molecular formulaC9H14OChEBI ↗
Molar mass138.21 g/molChEBI ↗
Monoisotopic mass138.10447 DaChEBI ↗
Formal charge0ChEBI ↗
ChEBI identifierCHEBI:89197ChEBI ↗

Names & structural identifiers

Copy any identifier
2-pentylfuran
2-pentylfuran
YVBAUDVGOFCUSG-UHFFFAOYSA-N
CCCCCc1ccco1
InChI=1S/C9H14O/c1-2-3-4-6-9-7-5-8-10-9/h5,7-8H,2-4,6H2,1H3

Classification & relationships

ChEBI ontology

Roles recorded in ChEBI

plant growth stimulatorvolatile oil componentflavouring agentinsect repellentAspergillus metabolitebacterial metabolitehuman urinary metabolite

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

Mass ↔ amount of substance

Calculated from sourced mass
Equivalent amount
0.00723537 mol

Uses 138.21 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 · 9 atoms
78.21%
O
Oxygen · 1 atom
11.58%
H
Hydrogen · 14 atoms
10.21%

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

Sources & record history

Checked 27 Sep 2026
EMBL-EBI ChEBI · CHEBI:89197

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

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.