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Name |
2-(4-Bromophenyl)imidazo[1,2-a]pyrimidine |
EINECS | N/A |
CAS No. | 56921-85-8 | Density | 1.58 g/cm3 |
PSA | 30.19000 | LogP | 3.15880 |
Solubility | N/A | Melting Point |
279℃ |
Formula | C12H8BrN3 | Boiling Point | N/A |
Molecular Weight | 274.12 | Flash Point | N/A |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-(4-BROMO-PHENYL)-IMIDAZO[1,2-A]PYRIMIDINE;imidazo[1,2-a]pyrimidine,2-(4-bromophenyl)-;2-(4-Bromo-phenyl)-imidazo[1,2-a] pyrimidine >99% |
Article Data | 11 |
This chemical is called 2-(4-Bromo-phenyl)-imidazo[1,2-a]pyrimidine. With the molecular formula of C12H8BrN3, its molecular weight is 274.12. The CAS registry number of this chemical is 56921-85-8.
Other characteristics of the 2-(4-Bromo-phenyl)-imidazo[1,2-a]pyrimidine can be summarised as followings: (1)ACD/LogP: 3.38; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.35; (4)ACD/LogD (pH 7.4): 3.38; (5)ACD/BCF (pH 5.5): 205.3; (6)ACD/BCF (pH 7.4): 216.63; (7)ACD/KOC (pH 5.5): 1549.14; (8)ACD/KOC (pH 7.4): 1634.68; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 30.19 Å2; (13)Index of Refraction: 1.712; (14)Molar Refractivity: 67.82 cm3; (15)Molar Volume: 173 cm3; (16)Polarizability: 26.88×10-24cm3; (17)Surface Tension: 54.6 dyne/cm; (18)Density: 1.58 g/cm3.
You can still convert the following datas into molecular structure:
1.SMILES: Brc3ccc(c1nc2ncccn2c1)cc3
2.InChI: InChI=1/C12H8BrN3/c13-10-4-2-9(3-5-10)11-8-16-7-1-6-14-12(16)15-11/h1-8H
3.InChIKey: MUBZZRZIBNKULO-UHFFFAOYAD