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CAS No.: | 63237-87-6 |
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Name: | PYRAZOLO[1,5-A]PYRIDINE-2,3-DICARBOXYLIC ACID |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C9H6N2O4 |
Molecular Weight: | 206.158 |
Synonyms: | Pyrazolo[1,5-a]pyridine-2,3-dicarboxylic acid 97%; |
Density: | 1.64 g/cm3 |
Melting Point: | 218-218.5 °C |
PSA: | 91.90000 |
LogP: | 0.73070 |
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The CAS register number of Pyrazolo[1,5-a]pyridine-2,3-dicarboxylicacid is 63237-87-6. It also can be called as Pyrazolo[1,5-a]pyridine-2,3-dicarboxylic acid 97%. The molecular formula about this chemical is C9H6N2O4 and the molecular weight is 206.15.
Physical properties about Pyrazolo[1,5-a]pyridine-2,3-dicarboxylicacid are: (1)ACD/LogP: 0.27; (2)ACD/LogD (pH 5.5): -3.87; (3)ACD/LogD (pH 7.4): -3.88; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 6; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 69.9 Å2; (12)Index of Refraction: 1.718; (13)Molar Refractivity: 49.33 cm3; (14)Molar Volume: 125.1 cm3; (15)Polarizability: 19.55x10-24cm3; (16)Surface Tension: 75.5 dyne/cm; (17)Density: 1.64 g/cm3.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)c1nn2c(c1C(=O)O)cccc2
(2)InChI: InChI=1/C9H6N2O4/c12-8(13)6-5-3-1-2-4-11(5)10-7(6)9(14)15/h1-4H,(H,12,13)(H,14,15)
(3)InChIKey: ALJPZXOFRCWHID-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C9H6N2O4/c12-8(13)6-5-3-1-2-4-11(5)10-7(6)9(14)15/h1-4H,(H,12,13)(H,14,15)
(5)Std. InChIKey: ALJPZXOFRCWHID-UHFFFAOYSA-N