1,3,5-Trifluoro-2,4,6-triiodobenzene - ≥98% , CAS No.84322-56-5

CAS: 84322-56-5 Cat. No.: T139310 Peso molecular: 509.77 Número EC: 828-314-0 PubChem CID: 3852430

GRADE & PURITY ≥98%

Synonyms

AMY28497 | MFCD06248899 | 1,3,5-trifluoro-2,4,6-triiodobenzene | 1,3,5-trifluoro-2,4,6-triiodo-benzene | TD1003 | YSWG082 | SCHEMBL6516734 | A25212 | SY041311 | Benzene, 1,3,5-trifluoro-2,4,6-triiodo- | DTXSID70397333 | BBL102181 | FT-0641947 | C6F3I3 | A

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Descripción general

A useful chemical for biological applications.

Specifications

Sinónimos

AMY28497 | MFCD06248899 | 1, 3, 5-trifluoro-2, 4, 6-triiodobenzene | 1, 3, 5-trifluoro-2, 4, 6-triiodo-benzene | TD1003 | YSWG082 | SCHEMBL6516734 | A25212 | SY041311 | Benzene, 1, 3, 5-trifluoro-2, 4, 6-triiodo- | DTXSID70397333 | BBL102181 | FT-0641947 | C6F3I3 | A

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Protected from light, Argon charged

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 488194606
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488194606
• Sonrisas canónicas: C1(=C(C(=C(C(=C1I)F)I)F)I)F
• IUPAC Name: 1,3,5-trifluoro-2,4,6-triiodobenzene
• InChIKey: NTAZOPPTLZSXQH-UHFFFAOYSA-N
• INCHI: 1S/C6F3I3/c7-1-4(10)2(8)6(12)3(9)5(1)11
• Isómeros SMILES: C1(=C(C(=C(C(=C1I)F)I)F)I)F
• PubChem CID: 3852430
• Peso molecular: 509.77

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Halobenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Halobenzenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Iodobenzenes
• Alternative Parents: Fluorobenzenes Aryl iodides Aryl fluorides Organoiodides Organofluorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Iodobenzene - Fluorobenzene - Aryl iodide - Aryl halide - Aryl fluoride - Hydrocarbon derivative - Organoiodide - Organofluoride - Organohalogen compound - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as iodobenzenes. These are aromatic compounds containing one or more iodine atoms attached to a benzene.
• 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

Propiedades químicas y físicas

• Solubilidad: Slightly soluble in water.
• Sensibilidad: Light sensitive
• Punto de fusión (°C): 152℃
• Peso molecular: 509.770 g/mol
• XLogP3: 4.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 509.709 Da
• Monoisotopic Mass: 509.709 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 122.000
• 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: 1

Referencias

1. Jian He, Aisen Li, Yanchun Tao, Ning Chu, Zhixiang Wang, Shuping Xu, Jing Wang, Houyu Zhang, Jingsheng Yu, Weiqing Xu.  (2019)  The remarkable structural comparison between two-dimensional and three-dimensional of 4, 4′-trimethylenedipyridine/1, 3, 5-trifluoro-2, 4, 6-triiodobenzene co-crystal.  THIN SOLID FILMS,      [PMID:] [10.1016/j.tsf.2019.06.024]