TEST Mixture
2-amino-2-(hydroxymethyl)propane-1,3-diol;2-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino]ethanesulfonic acid
Also Known As: Test Mixture|Ethanesulfonic acid, 2-((2-hydroxy-1,1-bis(hydroxymethyl)ethyl)amino)-, mixt. with 2-amino-2-(hydroxymethyl)-1,3-propanediol|2-{[1,3-Dihydroxy-2-(hydroxymethyl)propan-2-yl]amino}ethane-1-sulfonic acid--2-amino-2-(hydroxymethyl)propane-1,3-diol (1/1)|2-amino-2-(hydroxymethyl)propane-1,3-diol; 2-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino]ethanesulfonic acid|2-amino-2-(hydroxymethyl)propane-1,3-diol;2-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino]ethanesulfonic acid
| Molecular Formula | C10H26N2O9S |
|---|---|
| Molecular Weight | 350.1359 g/mol |
| LogP | -5.1597 |
| Topological Polar Surface Area | 222.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 10 |
| Exact Mass | 350.1359 |
| Monoisotopic Mass | 350.1359 |
| Heavy Atoms | 22 |
| Complexity | 287.0 |
Chemical Identifiers
| CAS Number | 77044-70-3 |
|---|---|
| SMILES | C(CS(=O)(=O)O)NC(CO)(CO)CO.C(C(CO)(CO)N)O |
| InChIKey | WGHXGMXQBMKJQR-UHFFFAOYSA-N |
Product Overview
TEST Mixture (CAS 77044-70-3), with molecular formula C10H26N2O9S and molecular weight 350.1359 g/mol. IUPAC: 2-amino-2-(hydroxymethyl)propane-1,3-diol;2-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino]ethanesulfonic acid.