| Identification | |
| Name: | 1,4-Piperazinedipropanesulfonicacid |
| Synonyms: | PIPPS;3,3'-Piperazine-1,4-diyldipropane-1-sulfonic acid;Piperazine-N,N'-bis(3-propanesulfonic acid); |
| CAS: | 5625-56-9 |
| EINECS: | 227-059-7 |
| Molecular Formula: | C10H22N2O6S2 |
| Molecular Weight: | 330.4215 |
| InChI: | InChI=1/C10H22N2O6S2/c13-19(14,15)9-1-3-11-5-7-12(8-6-11)4-2-10-20(16,17)18/h1-10H2,(H,13,14,15)(H,16,17,18) |
| Molecular Structure: |  |
| Properties | |
| Density: | 1.413 g/cm3 |
| Refractive index: | 1.552 |
| Solubility: | Solubility (1.0%Soln in NaHCO3 (aq.) ) : Complete and Clear |
| Appearance: | White Powder |
| Specification: |
The 1,4-Piperazinedipropanesulfonic acid with the cas number 5625-56-9 is also called PIPPS. The IUPAC name is 3-[4-(3-sulfopropyl)piperazin-1-yl]propane-1-sulfonic acid. Its EINECS registry number is 227-059-7. The molecular formula is C10H22N2O6S2. The properties of the chemical are: (1)ACD/LogP: -3.77; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -7.13; (4)ACD/LogD (pH 7.4): -7.42; (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: 8; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 109.98Å2; (13)Index of Refraction: 1.552; (14)Molar Refractivity: 74.77 cm3; (15)Molar Volume: 233.8 cm3; (16)Polarizability: 29.64×10-24cm3; (17)Surface Tension: 58.6 dyne/cm. You can still convert the following datas into molecular structure: |
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