FCCP | A repository of Fragrance Chemicals in Children’s Products

Butyl acetate

Chemical identification
Pubchem identifier	31272
CAS identifier	123-86-4
DSSTOX identifier	DTXSID3021982
IUPAC name	Butyl acetate
SMILES	CCCCOC(=O)C
InChI	InChI=1S/C6H12O2/c1-3-4-5-8-6(2)7/h3-5H2,1-2H3
InChIKey	DKPFZGUDAPQIHT-UHFFFAOYSA-N
Synonyms	Butyl acetate, n-; Butile (acetati di); 1-Butyl acetate; Acetate de butyle; n-Butyl acetate; Butyl ethanoate; Butyle (acetate de); Butyl acetate; Acetic acid, butyl ester; n-Butyl ethanoate; Butylacetaten; Butylacetat; Butylester kyseliny octove; Octan n-butylu; Acetic acid n-butyl ester

Download structure:
2D:MOL MOL2 SDF
3D:MOL MOL2 SDF PDB PDBQT

Odor profile
Odor classes	Pome
Reference	[1]

Presence in Children's products
Broad category	Toys
Subcategory	Aquatic Toys

Chemical classification based on ClassyFire
Chemical kingdom	Organic compounds
Chemical super-class	Organic acids and derivatives
Chemical class	Carboxylic acids and derivatives
Chemical subclass	Carboxylic acid derivatives

Natural source for the chemical
Organism	Kingdom	Genus	Family
Prunus salicina	Plantae	Prunus	Rosaceae
Nymphaea tenerinervia	Plantae	Nymphaea	Nymphaeaceae
Prunus armeniaca	Plantae	Prunus	Rosaceae
Nymphaea	Plantae	Nymphaea	Nymphaeaceae
Olea europaea	Plantae	Olea	Oleaceae
Reference	[1], [2], [3]

DISCLAIMER

FCCP is a repository of fragrance chemicals used in children’s products compiled and curated from published scientific literature. We are not responsible for any errors or omission of any chemicals or published scientific studies that reported fragrance chemicals used in children’s products. The users are advised to exercise their own judgement while using our resource. Importantly our goal is to build this resource on fragrance chemicals used in children’s products to enable future research towards better understanding of the hazardous potential of these chemicals and to frame better policy decisions. Hence, the views expressed in this work are solely based on our scientific understanding of the topic, and they do not necessarily reflect the views or policies of our employers or funders.