Basic Information | Post buying leads | Suppliers |
Name |
1H-Imidazole,2,5-dibromo-1-(triphenylmethyl)- |
EINECS | N/A |
CAS No. | 850429-53-7 | Density | 1.46 g/cm3 |
PSA | 17.82000 | LogP | 6.24830 |
Solubility | N/A | Melting Point |
154-158 °C |
Formula | C22H16Br2N2 | Boiling Point | 579.4 °C at 760 mmHg |
Molecular Weight | 468.18 | Flash Point | 304.2 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
2,5-Dibromo-1-tritylimidazole;2,5-Dibromo-1-trityl-1H-imidazole; |
The IUPAC name of 1H-Imidazole,2,5-dibromo-1-(triphenylmethyl)- is 2,5-dibromo-1-tritylimidazole. With the CAS registry number 850429-53-7, it is also named as 2,5-Dibromo-1-trityl-1H-imidazole. The product's categories are Blocks; Bromides ; Imidazoles. It should be stored in cold place. In addition, its molecular formula is C22H16Br2N2 and its molecular weight is 468.18.
The other characteristics of 1H-Imidazole,2,5-dibromo-1-(triphenylmethyl)- can be summarized as: (1)ACD/LogP: 7.36; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7.36; (4)ACD/LogD (pH 7.4): 7.36; (5)ACD/BCF (pH 5.5): 232571.06; (6)ACD/BCF (pH 7.4): 232586.64; (7)ACD/KOC (pH 5.5): 241516.59; (8)ACD/KOC (pH 7.4): 241532.77; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 17.82 Å2; (13)Index of Refraction: 1.651; (14)Molar Refractivity: 116.39 cm3; (15)Molar Volume: 318.5 cm3; (16)Polarizability: 46.14×10-24cm3; (17)Surface Tension: 48.4 dyne/cm; (18)Density: 1.46 g/cm3; (19)Flash Point: 304.2 °C; (20)Melting Point: 154-158 °C; (21)Enthalpy of Vaporization: 86.69 kJ/mol; (22)Boiling Point: 579.4 °C at 760 mmHg; (23)Vapour Pressure: 2.03E-13 mmHg at 25 °C.
People can use the following data to convert to the molecule structure.
(1)SMILES: Brc1cnc(Br)n1C(c2ccccc2)(c3ccccc3)c4ccccc4
(2)InChI: InChI=1/C22H16Br2N2/c23-20-16-25-21(24)26(20)22(17-10-4-1-5-11-17,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-16H
(3)InChIKey: GGUUMQXVXRVHTE-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C22H16Br2N2/c23-20-16-25-21(24)26(20)22(17-10-4-1-5-11-17,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-16H
(5)Std. InChIKey: GGUUMQXVXRVHTE-UHFFFAOYSA-N