Compound Identification
SMILES
CC(O)CCC(C)O[N+]([O-])=O
InChIKey
InChIKey=PAWWQEMXBSLVJC-UHFFFAOYSA-N
Formula
C6H13NO4
Mass
163.173
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organic oxoanionic compounds
-
Subclass
Organic nitrates
- Level 5 Alkyl nitrates
-
Subclass
Organic nitrates
-
Class
Organic oxoanionic compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organic oxoanionic compounds
Subclass
Organic nitrates
Intermediate Tree Nodes
Not available
Direct Parent
Alkyl nitrates
Alternative Parents
Secondary alcohols Organic nitro compounds Organic nitric acids and derivatives Organic zwitterions Organic salts Organic oxides Organic nitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aliphatic acyclic compounds
Substituents
Alkyl nitrate - Organic nitro compound - Secondary alcohol - Organic nitric acid or derivatives - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organic zwitterion - Organooxygen compound - Alcohol - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as alkyl nitrates. These are organic compounds containing a nitrate that is O-linked to an alkyl group.
External Descriptors
Not available