Compound Identification
SMILES
O=S1(=O)CCC(O1)C1=CC=CC=C1
InChIKey
InChIKey=XOIITSNFWVWVJY-UHFFFAOYSA-N
Formula
C9H10O3S
Mass
198.24
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Oxathiolanes
- Subclass Gamma sultones
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Class
Oxathiolanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Oxathiolanes
Subclass
Gamma sultones
Intermediate Tree Nodes
Not available
Direct Parent
Gamma sultones
Alternative Parents
Sulfonic acid esters Organosulfonic acid esters Benzene and substituted derivatives Oxacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Gamma-sultone - Benzenoid - Organosulfonic acid ester - Sulfonic acid ester - Monocyclic benzene moiety - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Oxacycle - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as gamma sultones. These are organic compounds containing a gamma-sultone, a Intramolecular cyclic ester of hydroxy sulfonic acid, with a SO ring bond, and three ring carbon atoms.
External Descriptors
Not available