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CAS No.: | 7234-88-0 |
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Name: | Tetraphenylene |
Molecular Structure: | |
Formula: | C24H16 |
Molecular Weight: | 304.38 |
Synonyms: | MolPort-003-931-399;Tetrabenzocyclooctatetraene; |
Density: | 1.19 g/cm3 |
Boiling Point: | 577.6 °C at 760 mmHg |
Flash Point: | 297.9 °C |
The Tetraphenylene, with the CAS registry number 7234-88-0, is also known as Tetrabenzocyclooctatetraene. This chemical's molecular formula is C24H16 and molecular weight is 304.38. What's more, its IUPAC name is also tetraphenylene. It is an organic compound, solid at room temperature. It is a member of the unsaturated polycyclic hydrocarbons class of compounds.
Physical properties of Tetraphenylene are: (1)ACD/LogP: 7.64; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7.639; (4)ACD/LogD (pH 7.4): 7.639; (5)ACD/BCF (pH 5.5): 376417.875; (6)ACD/BCF (pH 7.4): 376417.875; (7)ACD/KOC (pH 5.5): 340908.313; (8)ACD/KOC (pH 7.4): 340908.313; (9)Index of Refraction: 1.757; (10)Molar Refractivity: 104.939 cm3; (11)Molar Volume: 255.699 cm3; (12)Polarizability: 41.601×10-24cm3; (13)Surface Tension: 53.546 dyne/cm; (14)Density: 1.19 g/cm3; (15)Flash Point: 297.866 °C; (16)Enthalpy of Vaporization: 83.259 kJ/mol; (17)Boiling Point: 577.606 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC2=C3C=CC=CC3=C4C=CC=CC4=C5C=CC=CC5=C2C=C1
(2)InChI: InChI=1S/C24H16/c1-2-10-18-17(9-1)19-11-3-4-13-21(19)23-15-7-8-16-24(23)22-14-6-5-12-20(18)22/h1-16H
(3)InChIKey: KTQYWNARBMKMCX-UHFFFAOYSA-N