Compound Identification
SMILES
OC(=O)[C@H]1CC2(O[C@@H]1CCCBr)SCCCS2
InChIKey
InChIKey=PPZSITYHQOXRIX-DTWKUNHWSA-N
Formula
C11H17BrO3S2
Mass
341.28
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Dithianes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Dithianes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Dithianes
Alternative Parents
Oxolanes Monothioacetals Oxacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl bromides
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
1,3-dithiane - Monothioacetal - Oxolane - Oxacycle - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Alkyl bromide - Organooxygen compound - Organobromide - Organohalogen compound - Organic oxygen compound - Carbonyl group - Alkyl halide - Hydrocarbon derivative - Organic oxide - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as dithianes. These are compounds containing a dithiane moiety, which is composed of a cyclohexane core structure wherein two methylene units are replaced by sulfur centres.
External Descriptors
Not available