4-Amino-3,6-disulfonaphthalic anhydride dipotassium , CAS No.79539-35-8

CAS: 79539-35-8 Cat. No.: A1451387 Molecular Weight: 449.496 EC Number: 632-834-1 PubChem CID: 12868665

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

4-Amino-3,6-disulfonaphthalic anhydride dipotassium is a building block that can be used to systhese a useful dye for biological research purposes.

Specifications

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Names and Identifiers

• Canonical Smiles: C1=C(C=C2C3=C1C(=C(C=C3C(=O)OC2=O)S(=O)(=O)[O-])N)S(=O)(=O)[O-].[K+].[K+]
• IUPAC Name: dipotassium;8-amino-2,4-dioxo-3-oxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene-7,11-disulfonate
• InChIKey: MIOVHACHHDENNE-UHFFFAOYSA-L
• INCHI: 1S/C12H7NO9S2.2K/c13-10-5-1-4(23(16,17)18)2-6-9(5)7(12(15)22-11(6)14)3-8(10)24(19,20)21;;/h1-3H,13H2,(H,16,17,18)(H,19,20,21);;/q;2*+1/p-2
• Isomeric SMILES: C1=C(C=C2C3=C1C(=C(C=C3C(=O)OC2=O)S(=O)(=O)[O-])N)S(=O)(=O)[O-].[K+].[K+]
• WGK Germany: 3
• PubChem CID: 12868665
• Molecular Weight: 449.496

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Naphthalenes
      • Subclass Naphthalenecarboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Naphthalenes
• Subclass: Naphthalenecarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: 1,8-naphthalic anhydrides
• Alternative Parents: 2-naphthalene sulfonates 2-naphthalene sulfonic acids and derivatives 2-benzopyrans 1-sulfo,2-unsubstituted aromatic compounds Primary aromatic amines Dicarboxylic acids and derivatives Sulfonyls Organosulfonic acids Carboxylic acid anhydrides Amino acids and derivatives Oxacyclic compounds Organopnictogen compounds Hydrocarbon derivatives Organic oxides Organic potassium salts Organooxygen compounds Organic cations
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 1,8-naphthalic anhydride - Naphthalene sulfonate - 2-naphthalene sulfonic acid or derivatives - Naphthalene sulfonic acid or derivatives - 2-naphthalene sulfonate - Benzopyran - 2-benzopyran - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Dicarboxylic acid or derivatives - Primary aromatic amine - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Carboxylic acid anhydride - Organic sulfonic acid or derivatives - Amino acid or derivatives - Carboxylic acid derivative - Oxacycle - Organic alkali metal salt - Organoheterocyclic compound - Amine - Organic nitrogen compound - Organic salt - Primary amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic potassium salt - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic cation - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as 1,8-naphthalic anhydrides. These are organic aromatic compounds that contain a naphthalene carrying two carboxyl groups at the 1- and 8-positions. In naphthalene anhydrides, the two carboxyl groups at the 1- and 8-positions share one oxygen atom.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y