Diallyl Propyl Isocyanurate (stabilized with BHT) - ≥97%(GC) , CAS No.5320-25-2

CAS: 5320-25-2 Cat. No.: D155471 Peso molecular: 251.29 Número EC: 678-542-8

GRADE & PURITY ≥97%(GC)

Synonyms

1,3-Diallyl-5-propyl-1,3,5-triazinane-2,4,6-trione | MFCD00144514 | SCHEMBL2231866 | Diallyl Propyl Isocyanurate | FT-0635614 | 1,3-Di(prop-2-en-1-yl)-5-propyl-1,3,5-triazinane-2,4,6-trione | Diallyl Propyl Isocyanurate (stabilized with BHT) | Isocyanuric

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinónimos

1, 3-Diallyl-5-propyl-1, 3, 5-triazinane-2, 4, 6-trione | MFCD00144514 | SCHEMBL2231866 | Diallyl Propyl Isocyanurate | FT-0635614 | 1, 3-Di(prop-2-en-1-yl)-5-propyl-1, 3, 5-triazinane-2, 4, 6-trione | Diallyl Propyl Isocyanurate (stabilized with BHT) | Isocyanuric

Especificaciones y pureza

≥97%(GC)

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

Enviado en

Wet ice

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

Pureza

≥97%(GC)

Nombres e identificadores

• Sonrisas canónicas: CCCN1C(=O)N(C(=O)N(C1=O)CC=C)CC=C
• IUPAC Name: 1,3-bis(prop-2-enyl)-5-propyl-1,3,5-triazinane-2,4,6-trione
• InChIKey: ZIJDEADTCQKATN-UHFFFAOYSA-N
• INCHI: 1S/C12H17N3O3/c1-4-7-13-10(16)14(8-5-2)12(18)15(9-6-3)11(13)17/h4-5H,1-2,6-9H2,3H3
• Isómeros SMILES: CCCN1C(=O)N(C(=O)N(C1=O)CC=C)CC=C
• Peso molecular: 251.29
• Reaxy-Rn: 806793
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=806793&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Triazines
      • Subclass Triazinones

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Triazines
• Subclass: Triazinones
• Intermediate Tree Nodes: Not available
• Direct Parent: Triazinones
• Alternative Parents: 1,3,5-triazines Heteroaromatic compounds Ureas Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Triazinone - 1,3,5-triazine - Heteroaromatic compound - Urea - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as triazinones. These are compounds containing a triazine ring which bears a ketone group a carbon 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

Propiedades químicas y físicas

• Sensibilidad: heat sensitive
• Índice de refracción: 1.50
• Punto de ebullición (°C): 136°C/2mmHg(lit.)
• Peso molecular: 251.280 g/mol
• XLogP3: 1.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 251.127 Da
• Monoisotopic Mass: 251.127 Da
• Topological Polar Surface Area: 60.900 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 360.000
• 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