Compound Identification
SMILES
C[C@@H]1CCS[C@@H](O1)[C@H](O)C1=CC=CC=C1
InChIKey
InChIKey=XFWXGOKHSLTVGS-YUSALJHKSA-N
Formula
C12H16O2S
Mass
224.32
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Oxathianes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Oxathianes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Oxathianes
Alternative Parents
Benzene and substituted derivatives Monothioacetals Secondary alcohols Oxacyclic compounds Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzenoid - 1,3-oxathiane - Monocyclic benzene moiety - Monothioacetal - Secondary alcohol - Oxacycle - Organic oxygen compound - Hydrocarbon derivative - Aromatic alcohol - Organooxygen compound - Alcohol - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as oxathianes. These are compounds containing an oxathiane moiety, which consists of a saturated aliphatic six-member ring with one oxygen atom, a sulfur atom, and four carbon atoms. Isomers of oxaphospholane include 1,2-oxathiane, 1,3-oxathiane,and 1,4-oxathiane.
External Descriptors
Not available