Compound Identification
SMILES
OCC(Cl)(Br)[N+]([O-])=O
InChIKey
InChIKey=IPJLEVRHOYIFOH-UHFFFAOYSA-N
Formula
C2H3BrClNO3
Mass
204.4
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic 1,3-dipolar compounds
-
Class
Allyl-type 1,3-dipolar organic compounds
-
Subclass
Organic nitro compounds
- Level 5 C-nitro compounds
-
Subclass
Organic nitro compounds
-
Class
Allyl-type 1,3-dipolar organic compounds
-
Superclass
Organic 1,3-dipolar compounds
Kingdom
Organic compounds
Superclass
Organic 1,3-dipolar compounds
Class
Allyl-type 1,3-dipolar organic compounds
Subclass
Organic nitro compounds
Intermediate Tree Nodes
Not available
Direct Parent
C-nitro compounds
Alternative Parents
Chlorohydrins Bromohydrins Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Primary alcohols Organonitrogen compounds Organochlorides Organobromides Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives Alkyl chlorides Alkyl bromides
Molecular Framework
Aliphatic acyclic compounds
Substituents
Bromohydrin - Chlorohydrin - Halohydrin - C-nitro compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Alcohol - Organic zwitterion - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organochloride - Organobromide - Organic salt - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Alkyl chloride - Alkyl bromide - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as c-nitro compounds. These are compounds having the nitro group, -NO2 (free valence on nitrogen), which is attached to carbon.
External Descriptors
Not available