Structure Information
Structure

Compound Identification

SMILES

NCC1(CN(CN(C1)[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O

InChIKey

InChIKey=MPTFFQOENVNYMO-UHFFFAOYSA-N

Formula

C5H10N6O6

Mass

250.171

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazines

Subclass

Pyrimidines and pyrimidine derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Nitropyrimidines

Alternative Parents

Molecular Framework

Aliphatic heteromonocyclic compounds

Substituents

Nitropyrimidine - 1,3-diazinane - C-nitro compound - Organic nitro compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Amine - Primary amine - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Primary aliphatic amine - Organic salt - Hydrocarbon derivative - Organic oxygen compound - Organic cation - Aliphatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as nitropyrimidines. These are compounds containing a pyrimidine ring which bears a nitro group. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.

External Descriptors

Not available

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