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| CAS No.: | 876379-79-2 |
|---|---|
| Name: | 3-bromoH-pyrazolo[1,5-a]pyridine-5-carboxylic acid |
| Article Data: | 2 |
| Molecular Structure: | |
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| Formula: | C8H5BrN2O2 |
| Molecular Weight: | 239.95 |
| Synonyms: | 3-bromoH-pyrazolo[1,5-a]pyridine-5-carboxylic acid;3-bromopyrazolo[1,5-a]pyridine-5-carboxylic acid;3-broMopyrazolo[1;5-a]pyridine-5-carboxylic acid |
| Density: | 1.89 g/cm3 |
| PSA: | 54.60000 |
| LogP: | 1.79500 |
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- Total:23 Page 1 of 1 1
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Specification
The CAS registry number of Pyrazolo[1,5-a]pyridine-5-carboxylicacid, 3-bromo- is 876379-79-2. In addition, the molecular formula is C8H5BrN2O2 and the molecular weight is 239.95. The systematic name is 3-bromopyrazolo[1,5-a]pyridine-5-carboxylic acid. What's more, it should be stored in sealed container, and put in a cool and dry place.
Physical properties about Pyrazolo[1,5-a]pyridine-5-carboxylicacid, 3-bromo- are: (1)ACD/LogP: 2.13; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 54.6 Å2; (7)Index of Refraction: 1.728; (8)Molar Refractivity: 50.58 cm3; (9)Molar Volume: 126.9 cm3; (10)Polarizability: 20.05 ×10-24cm3; (11)Surface Tension: 66.4 dyne/cm; (12)Density: 1.89 g/cm3.
You can still convert the following datas into molecular structure:
(1)SMILES: c1cn2c(cc1C(=O)O)c(cn2)Br
(2)InChI: InChI=1/C8H5BrN2O2/c9-6-4-10-11-2-1-5(8(12)13)3-7(6)11/h1-4H,(H,12,13)
(3)InChIKey: HFRVEDSVNLUWFD-UHFFFAOYAX