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

Butylated hydroxytoluene

Chemical identification
Pubchem identifier	31404
CAS identifier	128-37-0
DSSTOX identifier	DTXSID3021982
IUPAC name	Butylated hydroxytoluene
SMILES	CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C
InChI	InChI=1S/C15H24O/c1-10-8-11(14(2,3)4)13(16)12(9-10)15(5,6)7/h8-9,16H,1-7H3
InChIKey	NLZUEZXRPGMBCV-UHFFFAOYSA-N
Synonyms	2,6-Di-t-butyl-p-cresol;Phenol, 2,6-bis(1,1-dimethylethyl)-4-methyl-;2,6-Bis(1,1-dimethylethyl)-4-methylphenol

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

Odor profile
Odor classes	Aromatic, Herbs, Mineral, Vegetable
Reference	[1]

Presence in Children's products
Broad category	Skin care
Subcategory	Baby Moisturizing Cream and Lotion

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
Oscillatoria sp.	Bacteria	Oscillatoria	Oscillatoriaceae
Botryococcus braunii	Protista	Botryococcus	Botryococcaceae
Aspergillus conicus	Plantae	Aspergillus	Trichocomaceae
Microcystis aeruginosa	Bacteria	Microcystis	Microcystaceae
Cylindrospermopsis raciborskii	Bacteria	Cylindrospermopsis	Aphanizomenonaceae
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.