Nuclear fast red - Biological stain , CAS No.6409-77-4

CAS: 6409-77-4 Cat. No.: N683437 分子式: C₁₄H₈NNaO₇S 分子量: 357.28 EC番号: 229-088-0

グレード＆純度 Biological Stain

Synonyms

NFR | Kernechtrot | Calcium Red | 4-Amino-9,10-dihydro-1,3-dihydroxy-9,10-dioxo-2-anthracenesulfonic acid

Storage

Protected from light,Argon charged,Desiccated,Room temperature

Shipped In

Normal

概要

It turns pale purple when exposed to sodium hydroxide and brown solution in sulfuric acid. Soluble in ethanol and water. The maximum absorption wavelength is 518nm. Irritating. There are also references that this product is Neutral red. Colour Index Number 60760 solubility in water: 1 g/l (25 c).

Nuclear staining of connective tissue. Reagent for determination of calcium in serum.

仕様

同義語

NFR | Kernechtrot | Calcium Red | 4-Amino-9,10-dihydro-1,3-dihydroxy-9,10-dioxo-2-anthracenesulfonic acid

仕様と純度

Biological stain

保管条件

Protected from light,Argon charged,Desiccated,Room temperature

入荷

Normal

等級

Biological Stain

名前と識別子

パブケム・シド

504769624

パブケム・シド・ウル

https://pubchem.ncbi.nlm.nih.gov/substance/504769624

カノニカル・スマイル

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C(=C3N)O)S(=O)(=O)[O-])O.[Na+]

IUPAC Name

sodium;4-amino-1,3-dihydroxy-9,10-dioxoanthracene-2-sulfonate

InChIKey

IFSXZLJQEKGQAF-UHFFFAOYSA-M

INCHI

1S/C14H9NO7S.Na/c15-9-7-8(12(18)14(13(9)19)23(20,21)22)11(17)6-4-2-1-3-5(6)10(7)16;/h1-4,18-19H,15H2,(H,20,21,22);/q;+1/p-1

異性体SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C(=C3N)O)S(=O)(=O)[O-])O.[Na+]

WGKドイツ

1

分子量

357.28

Reaxy-Rn

20093893

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=20093893&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 分類 Anthracenes
      • Subclass Anthraquinones

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 分類: Anthracenes
• Subclass: Anthraquinones
• Intermediate Tree Nodes: Not available
• Direct Parent: Hydroxyanthraquinones
• Alternative Parents: Arylsulfonic acids and derivatives Aryl ketones Vinylogous amides Vinylogous acids Sulfonyls Organosulfonic acids Primary amines Organopnictogen compounds Organic sodium salts Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Hydroxyanthraquinone - Arylsulfonic acid or derivatives - Aryl ketone - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Vinylogous amide - Vinylogous acid - Ketone - Organic alkali metal salt - Organic sodium salt - Amine - Hydrocarbon derivative - Organic oxide - Primary amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organic salt - Aromatic homopolycyclic compound
• 説明: This compound belongs to the class of organic compounds known as hydroxyanthraquinones. These are compounds containing a hydroxyanthraquinone moiety, which consists of an anthracene bearing a quinone, and hydroxyl group.
• 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

作用メカニズム

化学的性質と物理的性質

• 溶解度: 1 g/l (1% or 5% sodium bicarbonate aqueous solution, 25 ° C)
• 感度: Light sensitive；Moisture sensitive
• 融点（°C）: 300°C
• 分子量: 357.270 g/mol
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 1
• Exact Mass: 356.992 Da
• Monoisotopic Mass: 356.992 Da
• Topological Polar Surface Area: 166.000 Ų
• Heavy Atom Count: 24
• Formal Charge: 0
• Complexity: 634.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

XLogP3