Compound Identification
SMILES
CCC1OC(CC(Cl)C(O)C1CBr)C(Cl)CC=CC#C
InChIKey
InChIKey=MFEVKEHDTZDLJG-UHFFFAOYSA-N
Formula
C15H21BrCl2O2
Mass
384.14
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Oxepanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Oxepanes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Oxepanes
Alternative Parents
Secondary alcohols Chlorohydrins Oxacyclic compounds Dialkyl ethers Acetylides Organochlorides Organobromides Hydrocarbon derivatives Alkyl chlorides Alkyl bromides
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Oxepane - Chlorohydrin - Secondary alcohol - Halohydrin - Acetylide - Dialkyl ether - Oxacycle - Ether - Alcohol - Organobromide - Organohalogen compound - Organochloride - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Alkyl halide - Alkyl chloride - Alkyl bromide - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as oxepanes. These are compounds containing an oxepane ring, which is a seven-member saturated aliphatic heterocycle with one oxygen and six carbon atoms.
External Descriptors
Not available