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

2-Propylphenol

Chemical identification
Pubchem identifier	12570
CAS identifier	644-35-9
DSSTOX identifier	DTXSID9047702
IUPAC name	2-Propylphenol
SMILES	CCCC1=CC=CC=C1O
InChI	InChI=1S/C9H12O/c1-2-5-8-6-3-4-7-9(8)10/h3-4,6-7,10H,2,5H2,1H3
InChIKey	LCHYEKKJCUJAKN-UHFFFAOYSA-N
Synonyms	Phenol, 2-propyl-; 2-Propylphenol; 1-Hydroxy-2-n-propylbenzene; o-Propylphenol; 1-(2-Hydroxyphenyl)propane; 2-n-Propylphenol; Phenol, o-propyl-

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

Odor profile
Odor classes	Animal, Aromatic, Edible oil, Herbs, Maillard, Mineral, Processed meat, Vegetable
Reference	[1]

Presence in Children's products
Broad category	Toys
Subcategory	Toy Swords

Chemical classification based on ClassyFire
Chemical kingdom	Organic compounds
Chemical super-class	Benzenoids
Chemical class	Benzene and substituted derivatives
Chemical subclass	Phenylpropanes

Natural source for the chemical
Organism	Kingdom	Genus	Family
Lysimachia foenum-graecum	Plantae	Lysimachia	Primulaceae
Wollemia nobilis	Plantae	Wollemia	Araucariaceae
Reference	[1], [2]

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.