Dibenzo[g,p]chrysene - ≥98% , CAS No.191-68-4

CAS: 191-68-4 Cat. No.: D155976 Peso molecular: 328.41 Beilstein Registry Number: 5(4)2837

GRADE & PURITY ≥98%

Synonyms

NSC30878 | NSC-30878 | hexacyclo[12.12.0.0^{2,7.0^{8,13.0^{15,20.0^{21,26]hexacosa-1(14),2,4,6,8,10,12,15,17,19,21,23,25-tridecaene | AS-57354 | NSC 30878 | Dibenzo(g,p)chrysene | Dibenzo[a,c]triphenylene | 1,3,4,5,6,7,8-Tetrabenzonaphthalene | 7730GH8V7O

Storage

Store at 2-8°C,Cool

Shipped In

Wet ice

Specifications

Sinónimos

NSC30878 | NSC-30878 | hexacyclo[12.12.0.0^{2, 7.0^{8, 13.0^{15, 20.0^{21, 26]hexacosa-1(14), 2, 4, 6, 8, 10, 12, 15, 17, 19, 21, 23, 25-tridecaene | AS-57354 | NSC 30878 | Dibenzo(g, p)chrysene | Dibenzo[a, c]triphenylene | 1, 3, 4, 5, 6, 7, 8-Tetrabenzonaphthalene | 7730GH8V7O

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Cool

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

• Sonrisas canónicas: C1=CC=C2C(=C1)C3=CC=CC=C3C4=C2C5=CC=CC=C5C6=CC=CC=C64
• IUPAC Name: hexacyclo[12.12.0.02,7.08,13.015,20.021,26]hexacosa-1(14),2,4,6,8,10,12,15,17,19,21,23,25-tridecaene
• InChIKey: GQDKQZAEQBGVBS-UHFFFAOYSA-N
• INCHI: 1S/C26H16/c1-5-13-21-17(9-1)18-10-2-6-14-22(18)26-24-16-8-4-12-20(24)19-11-3-7-15-23(19)25(21)26/h1-16H
• Isómeros SMILES: C1=CC=C2C(=C1)C3=CC=CC=C3C4=C2C5=CC=CC=C5C6=CC=CC=C64
• Peso molecular: 328.41
• Beilstein: 5(4)2837
• Reaxy-Rn: 2055677
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2055677&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Phenanthrenes and derivatives
      • Subclass Triphenylenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Phenanthrenes and derivatives
• Subclass: Triphenylenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Triphenylenes
• Alternative Parents: Chrysenes Naphthalenes Aromatic hydrocarbons Polycyclic hydrocarbons Unsaturated hydrocarbons
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Triphenylene - Chrysene - Naphthalene - Aromatic hydrocarbon - Polycyclic hydrocarbon - Unsaturated hydrocarbon - Hydrocarbon - Aromatic homopolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as triphenylenes. These are compounds containing a triphenylene moiety, which consists of four fused benzene rings forming a 9,10-benzo[l]phenanthrene.
• 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

• Punto de fusión (°C): 218 °C
• Peso molecular: 328.400 g/mol
• XLogP3: 7.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 328.125 Da
• Monoisotopic Mass: 328.125 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 26
• Formal Charge: 0
• Complexity: 418.000
• 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. Zhongling Du, Tiantian Wang, Kun Gong, Yimeng Liang, Lulu Huang, Dongzhi Liu, Ruihong Liu, Tianyang Wang.  (2026)  Mechanically robust long-persistent luminescent hydrogels enabled by synergistic multi-level rigidity and confined crystallization.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2026.173009]