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

2-Benzylideneheptanal

Chemical identification
Pubchem identifier	1712058
CAS identifier	122-40-7
DSSTOX identifier	DTXSID8029157
IUPAC name	2-Benzylideneheptanal
SMILES	CCCCCC(=CC1=CC=CC=C1)C=O
InChI	InChI=1S/C14H18O/c1-2-3-5-10-14(12-15)11-13-8-6-4-7-9-13/h4,6-9,11-12H,2-3,5,10H2,1H3/b14-11-
InChIKey	HMKKIXGYKWDQSV-KAMYIIQDSA-N
Synonyms	2-Benzylideneheptal; alpha-Amyl-beta-phenylacrolein; Jasmildehyde; Pentylcinmaldehyde; 2-Pentylcinmaldehyde; Heptal, 2-(phenylmethylene)-; Jasmine aldehyde; Flomine; alpha-Amylcinmicaldehyde; Amyl cinmic aldehyde; alpha-Pentyl-beta-phenylacrolein; 2-(Phenylmethylene)-heptal; Amylcinmal; 2-(Phenylmethylene)heptal; Amylcinmaldehyde; Jasmil; Amyl cinmal; Cinmaldehyde, alpha-pentyl-; Amylcinmic acid aldehyde; alpha-Amyl cinmaldehyde; Heptal, 2-(phenylmethylene); Heptal, 2-benzylidene-

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

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

Presence in Children's products
Broad category	Hair care, Miscellaneous, Toys
Subcategory	Baby Shampoo And Shower Gel, General Baby products, Clay Toys

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

Synthetic product source
Product source	Air care products, Cleaning and furnishing care products, Laundry and dishwashing products
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.