Benzyl salicylate


Benzyl salicylate
DEDuCT identifierDED000180
Pubchem identifier8363
CAS identifier118-58-1
IUPAC nameBenzyl salicylate
Category based on type of supporting evidenceCategory II
Broad category based on environmental sourceConsumer Products, Agriculture and Farming
Sub-category based on environmental sourceFood additives, Household Supplies, Personal and Healthcare Products, Pesticide, Stationery, Tobacco Products
Chemical kingdomOrganic compounds
Chemical super-classBenzenoids
Chemical classBenzene and substituted derivatives
SMILESC1=CC=C(C=C1)COC(=O)C2=CC=CC=C2O
InChIInChI=1S/C14H12O3/c15-13-9-5-4-8-12(13)14(16)17-10-11-6-2-1-3-7-11/h1-9,15H,10H2
InChIKeyZCTQGTTXIYCGGC-UHFFFAOYSA-N

Download structure:
2D:2D MOL2D MOL22D SDF
3D:3D MOL3D MOL23D SDF3D PDB3D PDBQT

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