(S,S,S)-Triglycidyl Isocyanurate - ≥98%(N) , CAS No.240408-81-5

CAS: 240408-81-5 Cat. No.: S161248 Peso molecular: 297.27 Número EC: 678-564-8 PubChem CID: 90471145

GRADE & PURITY ≥98%(N)

Synonyms

Isocyanuric acid(S,S,S)-triglycidyl ester | 2,4,6-tris((S)-oxiran-2-ylmethoxy)-1,3,5-triazine | 1,3,5-tris[[(2S)-oxiran-2-yl]methyl]-1,3,5-triazinane-2,4,6-trione | Isocyanuric Acid (S,S,S)-Triglycidyl Ester | 2,4,6-tris[[(2S)-oxiran-2-yl]methoxy]-1,3,5-t

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

Isocyanuric acid(S, S, S)-triglycidyl ester | 2, 4, 6-tris((S)-oxiran-2-ylmethoxy)-1, 3, 5-triazine | 1, 3, 5-tris[[(2S)-oxiran-2-yl]methyl]-1, 3, 5-triazinane-2, 4, 6-trione | Isocyanuric Acid (S, S, S)-Triglycidyl Ester | 2, 4, 6-tris[[(2S)-oxiran-2-yl]methoxy]-1, 3, 5-t

Especificaciones y pureza

≥98%(N)

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥98%(N)

Nombres e identificadores

• Sonrisas canónicas: C1C(O1)COC2=NC(=NC(=N2)OCC3CO3)OCC4CO4
• IUPAC Name: 2,4,6-tris[[(2S)-oxiran-2-yl]methoxy]-1,3,5-triazine
• InChIKey: BLPURQSRCDKZNX-CIUDSAMLSA-N
• INCHI: 1S/C12H15N3O6/c1-7(16-1)4-19-10-13-11(20-5-8-2-17-8)15-12(14-10)21-6-9-3-18-9/h7-9H,1-6H2/t7-,8-,9-/m0/s1
• Isómeros SMILES: C1[C@H](O1)COC2=NC(=NC(=N2)OC[C@@H]3CO3)OC[C@@H]4CO4
• PubChem CID: 90471145
• Peso molecular: 297.27

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Triazines
      • Subclass 1,3,5-triazines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Triazines
• Subclass: 1,3,5-triazines
• Intermediate Tree Nodes: Not available
• Direct Parent: Alkoxy-S-triazines
• Alternative Parents: Alkyl aryl ethers Heteroaromatic compounds Oxacyclic compounds Epoxides Dialkyl ethers Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Alkoxy-s-triazine - Alkyl aryl ether - Heteroaromatic compound - Oxacycle - Azacycle - Ether - Oxirane - Dialkyl ether - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as alkoxy-s-triazines. These are aromatic compounds containing a 1,3,5-triazine ring that is substituted at the 2-position with an alkoxy group.
• 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

• Rotación específica [α]: -22° (C=0.4,H2O)
• Punto de fusión (°C): 107 °C
• Peso molecular: 297.260 g/mol
• XLogP3: 0.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 9
• Exact Mass: 297.096 Da
• Monoisotopic Mass: 297.096 Da
• Topological Polar Surface Area: 104.000 Ų
• Heavy Atom Count: 21
• Formal Charge: 0
• Complexity: 298.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 3
• 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