Compound Identification
SMILES
[Na+].[O-]C(=O)C1=CC2=C(C=C1)C(=O)OC2
InChIKey
InChIKey=DVYGCVDLILORNZ-UHFFFAOYSA-M
Formula
C9H5NaO4
Mass
200.125
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
-
Level 5
Phthalic acid and derivatives
- Level 6 P-phthalic acid and derivatives
-
Level 5
Phthalic acid and derivatives
-
Subclass
Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Phthalic acid and derivatives
Direct Parent
P-phthalic acid and derivatives
Alternative Parents
Phthalides Lactones Carboxylic acid salts Carboxylic acid esters Oxacyclic compounds Carboxylic acids Organooxygen compounds Organic sodium salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Para_phthalic_acid - Isobenzofuranone - Phthalide - Isocoumaran - Carboxylic acid ester - Carboxylic acid salt - Lactone - Carboxylic acid derivative - Oxacycle - Organic alkali metal salt - Carboxylic acid - Organoheterocyclic compound - Organic oxygen compound - Organic oxide - Organooxygen compound - Organic salt - Organic sodium salt - Hydrocarbon derivative - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as p-phthalic acid and derivatives. These are compounds containing a benzene ring bearing a carboxylic acid group at ring carbon atoms 1 and 4.
External Descriptors
Not available