Triphenylene

• CAS: 217-59-4
• Catalog Number: ACM217594-3
• Category: Arenes
• Molecular Weight: 228.3
• Molecular Formula: C18H12
• Synonyms: 9,10-Benzophenanthrene
• IUPAC Name: Triphenylene
• SMILES: C1=CC=C2C(=C1)C3=CC=CC=C3C4=CC=CC=C24
• InChI: InChI=1S/C18H12/c1-2-8-14-13(7-1)15-9-3-4-11-17(15)18-12-6-5-10-16(14)18/h1-12H
• InChI Key: SLGBZMMZGDRARJ-UHFFFAOYSA-N
• Boiling Point: 438 ºC
• Melting Point: 195-198 ºC
• Density: 1.302 g/ml
• Solubility: 1.80e-07 M
• Appearance: White to beige crystalline
• Application: Triphenylene is a versatile polycyclic aromatic hydrocarbon characterized by its white to beige crystalline needle-like appearance. It serves multiple purposes across various fields due to its unique properties. Primarily, triphenylene is instrumental in the development of semiconductor devices, owing to its ability to emit fluorescence in the ultraviolet region. As an ortho-fused polycyclic arene, consisting of four linked benzene rings, it acts as a fundamental building block for synthesizing macromolecular compounds with extensive conjugated structures. This makes it invaluable in the research of organic supramolecular materials, where it is used to explore advanced optics and electronics applications. Furthermore, triphenylene functions as a discotic mesogen in liquid crystalline materials, and plays a role in the creation of specific compounds such as triphenylene-2-carbaldehyde, showcasing its adaptability and significance in scientific research and industrial applications.
• Storage: room temp
• Assay: 0.98
• Complexity: 217
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 0
• EC Number: 205-922-9
• Exact Mass: 228.0939
• Formal Charge: 0
• Hazard Statements: H302
• H-Bond Acceptor: 0
• H-Bond Donor: 0
• Heavy Atom Count: 18
• Hydrogen Bond Acceptor Count: 0
• Hydrogen Bond Donor Count: 0
• Isotope Atom Count: 0
• LogP: 5.49 (LogP)
• MDL Number: MFCD00001108
• Monoisotopic Mass: 228.0939
• NSC Number: 57455
• Packaging: 1 g in glass bottle
• Quality Level: 100
• RIDADR: UN 3082 9 / PGIII
• Rotatable Bond Count: 0
• Symbol: GHS07
• Topological Polar Surface Area: 0 Ų
• UNII: 18WX3373I0
• Vapor Pressure: 2.10e-08 mmHg
• XLogP3: 4.9
• XLogP3-AA: 4.9

Custom Q&A

What is the PubChem CID for triphenylene?

The PubChem CID for triphenylene is 9170.

What is the molecular formula of triphenylene?

The molecular formula of triphenylene is C18H12.

What is the molecular weight of triphenylene?

The molecular weight of triphenylene is 228.3 g/mol.

What is the IUPAC name of triphenylene?

The IUPAC name of triphenylene is triphenylene.

What is the InChI key of triphenylene?

The InChI key of triphenylene is SLGBZMMZGDRARJ-UHFFFAOYSA-N.

What is the canonical SMILES of triphenylene?

The canonical SMILES of triphenylene is C1=CC=C2C(=C1)C3=CC=CC=C3C4=CC=CC=C24.

What is the CAS number of triphenylene?

The CAS number of triphenylene is 217-59-4.

What is the ChEMBL ID of triphenylene?

The ChEMBL ID of triphenylene is CHEMBL1797416.

What is the UNII of triphenylene?

The UNII of triphenylene is 18WX3373I0.

What is the Wikipedia page for triphenylene?

The Wikipedia page for triphenylene is "Triphenylene."