Compound Identification
SMILES
OC(CC(=O)C=CC1=CC=CC=C1)(C(F)(F)F)C(F)(F)F
InChIKey
InChIKey=FCNCOWMMRCEONO-UHFFFAOYSA-N
Formula
C13H10F6O2
Mass
312.211
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamic acids and derivatives
Alternative Parents
Styrenes b'-hydroxy-alpha,beta-unsaturated ketones Beta-hydroxy ketones Tertiary alcohols Enones Acryloyl compounds Fluorohydrins Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Cinnamic acid or derivatives - Styrene - B'-hydroxy-alpha,beta-unsaturated-ketone - Monocyclic benzene moiety - Beta-hydroxy ketone - Benzenoid - Tertiary alcohol - Alpha,beta-unsaturated ketone - Acryloyl-group - Enone - Fluorohydrin - Ketone - Halohydrin - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organic oxygen compound - Carbonyl group - Alcohol - Organooxygen compound - Alkyl halide - Alkyl fluoride - Organic oxide - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamic acids and derivatives. These are organic aromatic compounds containing a benzene and a carboxylic acid group (or a derivative thereof) forming 3-phenylprop-2-enoic acid.
External Descriptors
Not available