Methylene Blue hydrate - ≥96% , CAS No.122965-43-9

CAS: 122965-43-9 Cat. No.: M190219 Formule: C₁₆H₁₈ClN₃S·xH₂O Poids moléculaire: 319.85 (anhydrous basis) Numéro CE: 602-909-3

GRADE & PURITY ≥96%

Synonyms

UNII-O3YJW1TB3C | O3YJW1TB3C | (+/-)-5-bromo-2-aminoindane hydrobromide | E79163 | FT-0775246 | Zinc free Methylene Blue | AKOS015910302 | Methylene Blue hydrate | A890868 | Methylene Blue monohydrate | C.I 52015 | Methylene Blue hydrate, suitable for nuc

Storage

Room temperature

Shipped In

Normal

Vue d’ensemble

Methylene blue is used as a dye in different staining procedures viz. Wright's stain and Jenner's stain. It also serves as an indicator and medicine. Further, it is used to examine RNA and DNA under the microscope or in a gel. It is widely used as a redox indicator in analytical chemistry. It acts as a photosensitizer utilized to generate singlet oxygen in order to make organic peroxides by a Diels-Alder reaction. It is also used in the sulfide analysis. It plays an important role in aquaculture to treat fungal infections.

Specifications

Synonymes

UNII-O3YJW1TB3C | O3YJW1TB3C | (+/-)-5-bromo-2-aminoindane hydrobromide | E79163 | FT-0775246 | Zinc free Methylene Blue | AKOS015910302 | Methylene Blue hydrate | A890868 | Methylene Blue monohydrate | C.I 52015 | Methylene Blue hydrate, suitable for nuc

Spécifications et pureté

≥96%

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Pureté

≥96%

Noms et identifiants

Pubchem Sid

488199112

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488199112

Sourires canoniques

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

IUPAC Name

[7-(dimethylamino)phenothiazin-3-ylidene]-dimethylazanium;chloride;hydrate

InChIKey

WQVSELLRAGBDLX-UHFFFAOYSA-M

INCHI

1S/C16H18N3S.ClH.H2O/c1-18(2)11-5-7-13-15(9-11)20-16-10-12(19(3)4)6-8-14(16)17-13;;/h5-10H,1-4H3;1H;1H2/q+1;;/p-1

Isomères SMILES

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

Poids moléculaire

319.85 (anhydrous basis)

Reaxy-Rn

29647196

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=29647196&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Benzothiazines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Benzothiazines
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzothiazines
• Alternative Parents: Dialkylarylamines Benzenoids Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organic oxides Organic chloride salts Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Benzothiazine - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Benzenoid - Heteroaromatic compound - Tertiary amine - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic chloride salt - Organic salt - Organonitrogen compound - Amine - Aromatic heteropolycyclic compound
• Description: 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

Propriétés chimiques et physiques

• Solubilité: Soluble in water, alcohol, acetic acid, glycerol and chloroform. Insoluble in ether.
• Point de fusion (°C): 180℃
• Poids moléculaire: 337.900 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 337.102 Da
• Monoisotopic Mass: 337.102 Da
• Topological Polar Surface Area: 44.900 Ų
• Heavy Atom Count: 22
• Formal Charge: 0
• Complexity: 483.000
• 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: 3

XLogP3

Foire aux questions

What is the purity of this product?

This product is supplied at ≥96% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 122965-43-9, the molecular formula is C16H18ClN3S·xH2O, and the molecular weight is 319.85 (anhydrous basis) g/mol. InChIKey WQVSELLRAGBDLX-UHFFFAOYSA-M.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.