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CAS No.: | 33263-46-6 |
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Name: | 4-NITROPYRIDINE-3-SULFONIC ACID |
Molecular Structure: | |
Formula: | C5H4N2O5S |
Molecular Weight: | 204.163 |
Synonyms: | 4-nitro-3-pyridinesulfonic acid;3-Pyridinesulfonicacid,4-nitro; |
Density: | 1.74 g/cm3 |
PSA: | 121.46000 |
LogP: | 1.84050 |
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The 3-Pyridinesulfonicacid, 4-nitro- is an organic compound with the formula C5H4N2O5S. The systematic name of this chemical is 4-Nitropyridine-3-sulfonic acid. And the CAS registry number of this chemical is 33263-46-6. The product's category is Pyridines. Besides, its molecular weight is 204.16.
Physical properties about 3-Pyridinesulfonicacid, 4-nitro- are: (1)ACD/LogP: -1.14; (2)ACD/LogD (pH 5.5): -4.64; (3)ACD/LogD (pH 7.4): -4.64; (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: 7; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 110.46 Å2; (12)Index of Refraction: 1.615; (13)Molar Refractivity: 40.93 cm3; (14)Molar Volume: 117.2 cm3; (15)Polarizability: 16.22×10-24 cm3; (16)Surface Tension: 81.9 dyne/cm; (17)Density: 1.74 g/cm3.
You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C5H4N2O5S/c8-7(9)4-1-2-6-3-5(4)13(10,11)12/h1-3H,(H,10,11,12)
(2)InChIKey: YRKGGPRZGXMSDE-UHFFFAOYAB
(3)Std. InChI: InChI=1S/C5H4N2O5S/c8-7(9)4-1-2-6-3-5(4)13(10,11)12/h1-3H,(H,10,11,12)
(4)Std. InChIKey: YRKGGPRZGXMSDE-UHFFFAOYSA-N