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

7-Methoxycoumarin

Chemical identification
Pubchem identifier	10748
CAS identifier	531-59-9
DSSTOX identifier	DTXSID5060196
IUPAC name	7-Methoxycoumarin
SMILES	COC1=CC2=C(C=C1)C=CC(=O)O2
InChI	InChI=1S/C10H8O3/c1-12-8-4-2-7-3-5-10(11)13-9(7)6-8/h2-6H,1H3
InChIKey	LIIALPBMIOVAHH-UHFFFAOYSA-N
Synonyms	Ayapanin; Herniarine; 7-Methoxycoumarin; Herniarin (6CI); METHOXYCOURMARIN, 7-; 7-Methoxy-2H-1-benzopyran-2-one; Methylumbelliferone; Herniarin; 2H-1-Benzopyran-2-one, 7-methoxy-

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

Odor profile
Odor classes	Aromatic, Berry, Citrus, Dairy, Edible oil, Fermented, Floral, Fruity, Grain, Herbs, Maillard, Mineral, Pome, Stone spices, Sweet spices, Vegetable
Reference	[1]

Presence in Children's products
Broad category	Toys
Subcategory	Clay Toys, Plush Toys, Miscellaneous Toys

Chemical classification based on ClassyFire
Chemical kingdom	Organic compounds
Chemical super-class	Phenylpropanoids and polyketides
Chemical class	Coumarins and derivatives
Chemical subclass	Not available

Natural source for the chemical
Organism	Kingdom	Genus	Family
Artemisia dracunculus	Plantae	Artemisia	Asteraceae
Herniaria glabra	Plantae	Herniaria	Caryophyllaceae
Eupatorium triplinerve	Plantae	Eupatorium	Asteraceae
Carum carvi	Plantae	Carum	Apiaceae
Melilotus indica	Plantae	Melilotus	Fabaceae
Puccinia graminis	Fungi	Puccinia	Pucciniaceae
Matricaria chamomilla	Plantae	Matricaria	Asteraceae
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.