Azure B - Biological stain , CAS No.531-55-5

CAS: 531-55-5 Cat. No.: A278781 分子式: C₁₅H₁₆ClN₃S 分子量: 305.83 Beilstein Registry Number: 3922630 EC番号: 208-511-2

グレード＆純度 Biological Stain

Synonyms

DNDJEIWCTMMZBX-UHFFFAOYSA-N | DTXSID40944111 | A870807 | CHEBI:87639 | KFZNPGQYVZZSNV-UHFFFAOYSA-M | Azure B, prepared by direct synthesis | CCRIS 9314 | 7C8BEL8WQV | AKOS005287416 | N-methyl-N-(7-(methylamino)-3H-phenothiazin-3-ylidene)methanaminiumchlor

Storage

Room temperature

Shipped In

Normal

概要

All kinds of mixtures formed by oxidation of methylene blue, mainly azure A and B, are blue in aqueous solution, slightly soluble in ethanol and show reddish-brown fluorescence, and are used for biological dyeing.

仕様

同義語

DNDJEIWCTMMZBX-UHFFFAOYSA-N | DTXSID40944111 | A870807 | CHEBI:87639 | KFZNPGQYVZZSNV-UHFFFAOYSA-M | Azure B, prepared by direct synthesis | CCRIS 9314 | 7C8BEL8WQV | AKOS005287416 | N-methyl-N-(7-(methylamino)-3H-phenothiazin-3-ylidene)methanaminiumchlor

仕様と純度

Biological stain

生化学的・生理学的メカニズム

Azurite b is a cationic dye. It is part of Romanowsky stain for blood membrane staining. It can also be used for nucleic acid localization.

保管条件

Room temperature

入荷

Normal

等級

Biological Stain

名前と識別子

パブケム・シド

528771261

カノニカル・スマイル

CNC1=CC2=C(C=C1)N=C3C=CC(=[N+](C)C)C=C3S2.[Cl-]

IUPAC Name

dimethyl-[7-(methylamino)phenothiazin-3-ylidene]azanium;chloride

InChIKey

DNDJEIWCTMMZBX-UHFFFAOYSA-N

INCHI

1S/C15H15N3S.ClH/c1-16-10-4-6-12-14(8-10)19-15-9-11(18(2)3)5-7-13(15)17-12;/h4-9H,1-3H3;1H

異性体SMILES

CNC1=CC2=C(C=C1)N=C3C=CC(=[N+](C)C)C=C3S2.[Cl-]

WGKドイツ

3

RTECS

SO5550000

分子量

305.83

Beilstein

3922630

Reaxy-Rn

3922630

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3922630&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • 分類 Benzothiazines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• 分類: Benzothiazines
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzothiazines
• Alternative Parents: Secondary alkylarylamines Benzenoids Secondary ketimines Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organic chloride salts Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Benzothiazine - Secondary aliphatic/aromatic amine - Benzenoid - Heteroaromatic compound - Secondary ketimine - Azacycle - Secondary amine - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organic chloride salt - Organic salt - Organonitrogen compound - Amine - Aromatic heteropolycyclic compound
• 説明: This compound belongs to the class of organic compounds known as benzothiazines. These are organic compounds containing a benzene fused to a thiazine ring (a six-membered ring with four carbon atoms, one nitrogen atom and one sulfur 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

化学的性質と物理的性質

• 溶解度: Soluble in 1 mg/ml water. Sparingly soluble in alcohol.
• 感度: Moisture sensitive.
• 融点（°C）: 205 °C
• 分子量: 305.800 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 305.075 Da
• Monoisotopic Mass: 305.075 Da
• Topological Polar Surface Area: 52.700 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 498.000
• 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