3,3'-Ioduro de Dietiloxadicarbocyanina - ≥96% , CAS No.14806-50-9

CAS: 14806-50-9 Cat. No.: D155285 Peso molecular: 486.35 Número EC: 238-873-7 PubChem CID: 16211729

GRADE & PURITY ≥96%

Synonyms

DODCI | 3-ethyl-2-[5-(3-ethyl-2,3-dihydro-1,3-benzoxazol-2-ylidene)penta-1,3-dien-1-yl]-1,3-benzoxazol-3-ium iodide | AS-74631 | J-008437 | 3,3'-Diethyloxadicarbocyanine iodide | 3-Ethyl-2-(5-(3-ethylbenzo[d]oxazol-2(3H)-ylidene)penta-1,3-dien-1-yl)benzo[

Storage

Room temperature

Shipped In

Normal

Descripción general

Descripción del producto:

3,3′-Diethyloxadicarbocyanine iodide, también conocido como DODCI es un colorante láser que pertenece al grupo de los colorantes de cianina.

Aplicación del producto：

el yoduro de 3,3′-diethyloxadicarbocyanine es un colorante adecuado para el bloqueo de modo de los láseres de rodamina 6G sintonizables tanto en pulsos como en cw. Se ha utilizado como sonda micelar, ya que tiene carga positiva y permanece en la interfaz micela-agua.

Specifications

Sinónimos

DODCI | 3-ethyl-2-[5-(3-ethyl-2, 3-dihydro-1, 3-benzoxazol-2-ylidene)penta-1, 3-dien-1-yl]-1, 3-benzoxazol-3-ium iodide | AS-74631 | J-008437 | 3, 3'-Diethyloxadicarbocyanine iodide | 3-Ethyl-2-(5-(3-ethylbenzo[d]oxazol-2(3H)-ylidene)penta-1, 3-dien-1-yl)benzo[

Especificaciones y pureza

≥96%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥96%

Nombres e identificadores

• Pubchem Sid: 488199119
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488199119
• Sonrisas canónicas: CCN1C2=CC=CC=C2OC1=CC=CC=CC3=[N+](C4=CC=CC=C4O3)CC.[I-]
• IUPAC Name: (2E)-3-ethyl-2-[(2E,4E)-5-(3-ethyl-1,3-benzoxazol-3-ium-2-yl)penta-2,4-dienylidene]-1,3-benzoxazole;iodide
• InChIKey: CLDZYSUDOQXJOU-UHFFFAOYSA-M
• INCHI: 1S/C23H23N2O2.HI/c1-3-24-18-12-8-10-14-20(18)26-22(24)16-6-5-7-17-23-25(4-2)19-13-9-11-15-21(19)27-23;/h5-17H,3-4H2,1-2H3;1H/q+1;/p-1
• Isómeros SMILES: CCN\1C2=CC=CC=C2O/C1=C/C=C/C=C/C3=[N+](C4=CC=CC=C4O3)CC.[I-]
• PubChem CID: 16211729
• Peso molecular: 486.35
• Reaxy-Rn: 4118833

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Benzoxazolines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Benzoxazolines
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzoxazolines
• Alternative Parents: Benzoxazoles Benzenoids Oxazoles Heteroaromatic compounds Ketene acetals Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic iodide salts Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Benzoxazole - Benzoxazoline - Benzenoid - Azole - Oxazole - Heteroaromatic compound - Ketene acetal or derivatives - Oxacycle - Azacycle - Organic iodide salt - Organic salt - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as benzoxazolines. These are organic compounds containing a benzene ring fused to an oxazoline ring. Oxazoline is five-membered unsaturated ring with a nitrogen atom and an oxygen atom at the 1- and 3-position, respectively. Additionally, it contains two double bonds.
• External Descriptors: cyanine dye - organic iodide salt - 1,3-benzoxazoles

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

Propiedades químicas y físicas

• Sensibilidad: Light Sensitive
• Punto de fusión (°C): 232 °C
• Peso molecular: 486.300 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 486.08 Da
• Monoisotopic Mass: 486.08 Da
• Topological Polar Surface Area: 29.500 Ų
• Heavy Atom Count: 28
• Formal Charge: 0
• Complexity: 537.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 3
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 3
• Covalently-Bonded Unit Count: 2

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