2,4,6-tris(4-formylphenoxy)-1,3,5-triazine - ≥97% , CAS No.3140-75-8

CAS: 3140-75-8 Cat. No.: B300745 Peso molecular: 441.40

GRADE & PURITY ≥97%

Synonyms

E84072 | SCHEMBL9276142 | YSZC201 | 4,4',4''-((1,3,5-Triazine-2,4,6-triyl)tris(oxy))tribenzaldehyde | 4,4,4-((1,3,5-Triazine-2,4,6-triyl)tris(oxy))tribenzaldehyde | 2,4,6-tris(p-formylphenoxy)-1,3,5-triazine | 2,4,6-Tris(4-formylphenoxy)-1,3,5-triazine |

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

E84072 | SCHEMBL9276142 | YSZC201 | 4, 4', 4''-((1, 3, 5-Triazine-2, 4, 6-triyl)tris(oxy))tribenzaldehyde | 4, 4, 4-((1, 3, 5-Triazine-2, 4, 6-triyl)tris(oxy))tribenzaldehyde | 2, 4, 6-tris(p-formylphenoxy)-1, 3, 5-triazine | 2, 4, 6-Tris(4-formylphenoxy)-1, 3, 5-triazine |

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, 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

≥97%

Nombres e identificadores

• Pubchem Sid: 504766695
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504766695
• Sonrisas canónicas: C1=CC(=CC=C1C=O)OC2=NC(=NC(=N2)OC3=CC=C(C=C3)C=O)OC4=CC=C(C=C4)C=O
• IUPAC Name: 4-[[4,6-bis(4-formylphenoxy)-1,3,5-triazin-2-yl]oxy]benzaldehyde
• InChIKey: YNLBSRHGIHAPAE-UHFFFAOYSA-N
• INCHI: 1S/C24H15N3O6/c28-13-16-1-7-19(8-2-16)31-22-25-23(32-20-9-3-17(14-29)4-10-20)27-24(26-22)33-21-11-5-18(15-30)6-12-21/h1-15H
• Isómeros SMILES: C1=CC(=CC=C1C=O)OC2=NC(=NC(=N2)OC3=CC=C(C=C3)C=O)OC4=CC=C(C=C4)C=O
• Peso molecular: 441.40
• Reaxy-Rn: 366225
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=366225&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Clase Organooxygen compounds
      • Subclass Ethers

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Clase: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Diarylethers
• Alternative Parents: Phenoxy compounds Phenol ethers Benzoyl derivatives Benzaldehydes 1,3,5-triazines Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Diaryl ether - Benzaldehyde - Phenoxy compound - Benzoyl - Phenol ether - Aryl-aldehyde - 1,3,5-triazine - Benzenoid - Triazine - Monocyclic benzene moiety - Heteroaromatic compound - Organoheterocyclic compound - Azacycle - Aldehyde - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as diarylethers. These are organic compounds containing the dialkyl ether functional group, with the formula ROR', where R and R' are aryl groups.
• 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

• Sensibilidad: Air sensitive
• Punto de fusión (°C): 181℃
• Peso molecular: 441.400 g/mol
• XLogP3: 3.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 9
• Exact Mass: 441.096 Da
• Monoisotopic Mass: 441.096 Da
• Topological Polar Surface Area: 118.000 Ų
• Heavy Atom Count: 33
• Formal Charge: 0
• Complexity: 530.000
• 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