MOLECULE
Hexyl acetate
Hexyl acetate is the acetate ester of hexan-1-ol. It has a role as a metabolite. It is functionally related to a hexan-1-ol.
Summary from ChEBI, via PubChem.
Identity
Chemistry
- Formula
- C8H16O2
- Molecular weight
- 144.21 g/mol
- IUPAC name
- hexyl acetate
- InChIKey
- AOGQPLXWSUTHQB-UHFFFAOYSA-N
- SMILES
- CCCCCCOC(=O)C
- PubChem
- CID 8908 ↗
Provenance
Contributing sources
- PubChem
- ChEBI
- LOTUS
Natural occurrence
Found in
- Guava 3
- Tomato 2
- A. sellowiana 1
- Rooibos 1
- Oat 1
- B. carteri 1
- Frankincense 1
- Hemp 1
- C. ambiguum 1
- C. iyo 1
- Melon 1
- D. officinale 1
- E. coli 1
- F. arundinacea 1
- Red fescue 1
- Mangostan 1
- Soybean 1
- H. ambiguum 1
- H. antasiaticum 1
- H. persicum 1
- Lavender 1
- Japanese honeysuckle 1
- M. domestica 1
- Apple 1
- Love Apple 1
- Mandrake 1
- Mamajen 1
- Olive 1
- O. aristata 1
- Chinese peony 1
- Passion fruit 1
- Norway Spruce 1
- Seneca snakeroot 1
- P. bispina 1
- Pomegranate 1
- Chinese pear 1
- Coast Live Oak 1
- S. reuteriana 1
- Hog plum 1
- T. matsutake 1
- Muscadine 1
41 organisms, ranked by how many independent papers report the compound in each. Occurrence data from LOTUS, across 39 references.
Reported associations
Disease associations
-
Solvents, acute toxic effect Acute Poisoning
Associations recorded for the compound itself. A metabolomics association means it was detected or studied in that condition, not that it treats or causes it; an occupational entry describes a hazard of exposure. Neither is a therapeutic claim about any product.
Evidence