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Basic Information
CAS No.: 89949-06-4
Name: PYRIDINE-2,6-DISULFONIC ACID
Molecular Structure:
Molecular Structure of 89949-06-4 (PYRIDINE-2,6-DISULFONIC ACID)
Formula: C5H5NO6S2
Molecular Weight: 239.23
Synonyms: PYRIDINE-2,6-DISULFONIC ACID
Density: 1.865 g/cm3
PSA: 138.39000
LogP: 1.73660
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Specification

The 2,6-Pyridinedisulfonicacid, with CAS registry number 89949-06-4, belongs to the following product category:  Pyridines. It has the systematic name of pyridine-2,6-disulfonic acid. Its molecular weight is 239.23. And the chemical formula of this chemical is C5H5NO6S2.

Physical properties of 2,6-Pyridinedisulfonicacid: (1)ACD/LogP: -1.76; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -6.25; (4)ACD/LogD (pH 7.4): -6.25; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 7; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 116.39 Å2; (13)Index of Refraction: 1.623; (14)Molar Refractivity: 45.25 cm3; (15)Molar Volume: 128.2 cm3; (16)Polarizability: 17.93×10-24cm3; (17)Surface Tension: 86.2 dyne/cm; (18)Density: 1.865 g/cm3.

You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(O)c1nc(ccc1)S(=O)(=O)O
(2)InChI: InChI=1/C5H5NO6S2/c7-13(8,9)4-2-1-3-5(6-4)14(10,11)12/h1-3H,(H,7,8,9)(H,10,11,12)
(3)InChIKey: GAYUPWHNYPOANO-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C5H5NO6S2/c7-13(8,9)4-2-1-3-5(6-4)14(10,11)12/h1-3H,(H,7,8,9)(H,10,11,12)
(5)Std. InChIKey: GAYUPWHNYPOANO-UHFFFAOYSA-N