2-Hydroxy-3-[4-(2-hydroxyethyl)-1-piperazinyl]propane-1-sulfonic Acid - CAS 68399-78-0
Catalog: |
BB033546 |
Product Name: |
2-Hydroxy-3-[4-(2-hydroxyethyl)-1-piperazinyl]propane-1-sulfonic Acid |
CAS: |
68399-78-0 |
Synonyms: |
2-hydroxy-3-[4-(2-hydroxyethyl)-1-piperazinyl]-1-propanesulfonic acid; 2-hydroxy-3-[4-(2-hydroxyethyl)piperazin-1-yl]propane-1-sulfonic acid |
IUPAC Name: | 2-hydroxy-3-[4-(2-hydroxyethyl)piperazin-1-yl]propane-1-sulfonic acid |
Description: | HEPPSO is a buffering agent with working pH range in aqueous solution: 7.1-8.5. |
Molecular Weight: | 268.33 |
Molecular Formula: | C9H20N2O5S |
Canonical SMILES: | C1CN(CCN1CCO)CC(CS(=O)(=O)O)O |
InChI: | InChI=1S/C9H20N2O5S/c12-6-5-10-1-3-11(4-2-10)7-9(13)8-17(14,15)16/h9,12-13H,1-8H2,(H,14,15,16) |
InChI Key: | GIZQLVPDAOBAFN-UHFFFAOYSA-N |
Purity: | ≥ 99 % |
Density: | 1.382 g/cm3 |
Appearance: | White powder |
MDL: | MFCD00038351 |
LogP: | -1.19840 |
GHS Hazard Statement: | H301 (92.68%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
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PMID | Publication Date | Title | Journal |
21998565 | 20111001 | Identification of a novel class of farnesylation targets by structure-based modeling of binding specificity | PLoS computational biology |
19761218 | 20091027 | Oligosaccharide binding in Escherichia coli glycogen synthase | Biochemistry |
19244233 | 20090626 | The crystal structures of the open and catalytically competent closed conformation of Escherichia coli glycogen synthase | The Journal of biological chemistry |
17927842 | 20071011 | Transcriptional regulation of human eosinophil RNases by an evolutionary- conserved sequence motif in primate genome | BMC molecular biology |
15825220 | 20050501 | Piperazine-based buffers for liposome coating of capillaries for electrophoresis | Electrophoresis |
Complexity: | 308 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 268.10929292 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 7 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 268.10929292 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 110 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -4.6 |
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