1,3,5-Triazine,2,4,6-tris(4-bromophenyl)- supplier

Name
2,4,6-TRIS(4-BROMOPHENYL)-1,3,5-TRIAZINE
EINECS
CAS No. 30363-03-2
Article Data47
CAS DataBase
Density 1.741g/cm³
Solubility
Melting Point >300 °C(Solv: chloroform (67-66-3))
Formula C₂₁H₁₂Br₃N₃
Boiling Point 633.4 °C at 760 mmHg
Molecular Weight 546.058
Flash Point 336.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms s-Triazine,2,4,6-tris(p-bromophenyl)- (8CI);2,4,6-Tris(4-bromophenyl)-1,3,5-triazine;2,4,6-Tris(p-bromophenyl)triazine;
PSA 38.67000
LogP 7.16010

1,3,5-Triazine,2,4,6-tris(4-bromophenyl)- Specification

The 1,3,5-Triazine,2,4,6-tris(4-bromophenyl)-, with the CAS registry number 30363-03-2, is also known as 2,4,6-Tris(p-bromophenyl)-s-triazine. This chemical's molecular formula is C₂₁H₁₂Br₃N₃ and molecular weight is 546.0521. Its systematic name is called 2,4,6-tris(4-bromophenyl)-1,3,5-triazine.

Physical properties of 1,3,5-Triazine,2,4,6-tris(4-bromophenyl)-: (1)ACD/LogP: 8.36; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 8.36; (4)ACD/LogD (pH 7.4): 8.36; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 845517.5; (8)ACD/KOC (pH 7.4): 845519.31; (9)#H bond acceptors: 3; (10)#Freely Rotating Bonds: 3; (11)Index of Refraction: 1.671; (12)Molar Refractivity: 117.37 cm³; (13)Molar Volume: 313.5 cm³; (14)Surface Tension: 56.9 dyne/cm; (15)Density: 1.741 g/cm³; (16)Flash Point: 336.9 °C; (17)Enthalpy of Vaporization: 90.22 kJ/mol; (18)Boiling Point: 633.4 °C at 760 mmHg; (19)Vapour Pressure: 2.93E-15 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc4ccc(c1nc(nc(n1)c2ccc(Br)cc2)c3ccc(Br)cc3)cc4
(2)InChI: InChI=1/C21H12Br3N3/c22-16-7-1-13(2-8-16)19-25-20(14-3-9-17(23)10-4-14)27-21(26-19)15-5-11-18(24)12-6-15/h1-12H
(3)InChIKey: WZYVDGDZBNQVCF-UHFFFAOYAM

Product Name

2,4,6-TRIS(4-BROMOPHENYL)-1,3,5-TRIAZINE

1,3,5-Triazine,2,4,6-tris(4-bromophenyl)- Specification

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