Compound Identification
SMILES
O[C@@H]([C@H]1COCCC1=O)C1=CC=C(F)C=C1
InChIKey
InChIKey=WNFBKLZZNHUBDV-CMPLNLGQSA-N
Formula
C12H13FO3
Mass
224.231
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Halobenzenes
- Level 5 Fluorobenzenes
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Subclass
Halobenzenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Halobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Fluorobenzenes
Alternative Parents
Oxanes Aryl fluorides Secondary alcohols Cyclic ketones Oxacyclic compounds Dialkyl ethers Organofluorides Organic oxides Hydrocarbon derivatives Aromatic alcohols Aldehydes
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Fluorobenzene - Aryl fluoride - Aryl halide - Oxane - Cyclic ketone - Secondary alcohol - Ketone - Dialkyl ether - Oxacycle - Organoheterocyclic compound - Ether - Alcohol - Organohalogen compound - Organofluoride - Organooxygen compound - Aromatic alcohol - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Aldehyde - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as fluorobenzenes. These are compounds containing one or more fluorine atoms attached to a benzene ring.
External Descriptors
Not available