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Name |
5-Bromo[1,2,4]triazolo[1,5-a]pyridine |
EINECS | N/A |
CAS No. | 143329-58-2 | Density | 1.891 g/cm3 |
PSA | 30.19000 | LogP | 1.49180 |
Solubility | N/A | Melting Point |
145-150°C |
Formula | C6H4BrN3 | Boiling Point | N/A |
Molecular Weight | 198.022 | Flash Point | N/A |
Transport Information | N/A | Appearance | N/A |
Safety | 26 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
5-Bromo[1,2,4]triazolo[1,5-a]pyridine |
Article Data | 3 |
The 5-Bromo[1,2,4]triazolo[1,5-a]pyridine, with cas registry number 143329-58-2, belongs to the following product categories: (1)Building Blocks; (2)Pyridine. Its systematic name and its IUPAC name are the same, which is 5-bromo[1,2,4]triazolo[1,5-a]pyridine. Besides this, it is also called [1,2,4]Triazolo[1,5-a]pyridine, 5-bromo-.
Physical properties about this chemical are: (1)ACD/LogP: 0.27; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 8; (6)ACD/BCF (pH 7.4): 8; (7)ACD/KOC (pH 5.5): 147; (8)ACD/KOC (pH 7.4): 147; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 30.19 Å2; (13)Index of Refraction: 1.751; (14)Molar Refractivity: 42.715 cm3; (15)Molar Volume: 104.7 cm3; (16)Polarizability: 16.934 10-24cm3; (17)Surface Tension: 61.834 dyne/cm.
You can still convert the following datas into molecular structure:
(1)SMILES: Brc1cccc2ncnn12
(2)InChI: InChI=1/C6H4BrN3/c7-5-2-1-3-6-8-4-9-10(5)6/h1-4H
(3)InChIKey: FTRKHVUBTUHSQK-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C6H4BrN3/c7-5-2-1-3-6-8-4-9-10(5)6/h1-4H
(5)Std. InChIKey: FTRKHVUBTUHSQK-UHFFFAOYSA-N