Compound Identification
SMILES
O[C@@H]1CO[C@@H]2[C@H](CO[C@H]12)OC1=CC=CC(=C1)C(F)(F)F
InChIKey
InChIKey=WGYWGWQQKWOAEA-WRWGMCAJSA-N
Formula
C13H13F3O4
Mass
290.238
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Furofurans
- Subclass Isosorbides
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Class
Furofurans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Furofurans
Subclass
Isosorbides
Intermediate Tree Nodes
Not available
Direct Parent
Isosorbides
Alternative Parents
Trifluoromethylbenzenes Phenoxy compounds Phenol ethers Alkyl aryl ethers Oxolanes Secondary alcohols Oxacyclic compounds Dialkyl ethers Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Trifluoromethylbenzene - Isosorbide - Phenoxy compound - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Oxolane - Secondary alcohol - Oxacycle - Ether - Dialkyl ether - Organooxygen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Alcohol - Alkyl halide - Alkyl fluoride - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isosorbides. These are organic polycyclic compounds containing an isosorbide(1,4-Dianhydrosorbitol) moiety, which consists of two -oxolan-3-ol rings.
External Descriptors
Not available