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Cas Database |
| Name |
Boroxin,2,4,6-tris(4-methylphenyl)- |
EINECS | N/A |
| CAS No. | 5084-80-0 | Density | 1.09 g/cm3 |
| PSA | 27.69000 | LogP | 2.16120 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C21H21B3O3 | Boiling Point | 408.9 °C at 760 mmHg |
| Molecular Weight | 353.829 | Flash Point | 201.1 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Boroxin,tri-p-tolyl- (6CI,7CI,8CI);2,4,6-Tri-p-tolylcyclotrioxaborane;Tri(p-tolyl)boroxine;Tris(4-Methylphenyl)boroxin;Tris(4-tolyl)boroxin; |
Article Data | 54 |
Boroxin,2,4,6-tris(4-methylphenyl)- Specification
The Boroxin,2,4,6-tris(4-methylphenyl)-, with the CAS registry number 5084-80-0, is also known as Boroxin, tris(4-methylphenyl)- and 2,4,6-Tris(4-methylphenyl)boroxin. This chemical's molecular formula is C21H21B3O3 and molecular weight is 353.8226. What's more, its systematic name is Tris(4-methylphenyl)boroxin.
Physical properties about Boroxin,2,4,6-tris(4-methylphenyl)- are: (1)#H bond acceptors: 3; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 3; (4)Polar Surface Area: 27.69 Å2; (5)Index of Refraction: 1.555; (6)Molar Refractivity: 103.63 cm3; (7)Molar Volume: 322.7 cm3; (8)Polarizability: 41.08×10-24 cm3; (9)Surface Tension: 37.7 dyne/cm; (10)Density: 1.09 g/cm3; (11)Flash Point: 201.1 °C; (12)Enthalpy of Vaporization: 63.53 kJ/mol; (13)Boiling Point: 408.9 °C at 760 mmHg; (14)Vapour Pressure: 1.6E-06 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O1B(OB(OB1c2ccc(cc2)C)c3ccc(cc3)C)c4ccc(cc4)C
(2) InChI: InChI=1/C21H21B3O3/c1-16-4-10-19(11-5-16)22-25-23(20-12-6-17(2)7-13-20)27-24(26-22)21-14-8-18(3)9-15-21/h4-15H,1-3H3
(3) InChIKey: YIAIFWGNIWYFPC-UHFFFAOYAB
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