Structure Information
Structure

Compound Identification

SMILES

O[C@@H]1CO[C@@H]2[C@H](CO[C@H]12)OCCCC1=CC(=CC=C1)C(F)(F)F

InChIKey

InChIKey=JTARBFWWBQGOLM-LXTVHRRPSA-N

Formula

C16H19F3O4

Mass

332.319

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Furofurans

Subclass

Isosorbides

Intermediate Tree Nodes

Not available

Direct Parent

Isosorbides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Isosorbide - Trifluoromethylbenzene - Monocyclic benzene moiety - Benzenoid - Oxolane - Secondary alcohol - Ether - Dialkyl ether - Oxacycle - Alkyl fluoride - Organooxygen compound - Organofluoride - Organohalogen compound - Organic oxygen compound - Alcohol - Alkyl halide - Hydrocarbon derivative - 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

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