| solubility |
H2O: soluble50mg/mL, clear, colorless |
| PH |
5.5-7.5 (25℃, 50mg/mL in H2O) |
| optical activity |
[α]/D -24±1.5°, c = 0.5 in H2O |
| Water Solubility |
H2O: 50mg/mL, clear, colorless |
| InChI |
InChI=1/2C7H12O8.C4H5N.Mg/c2*8-1-2(9)3(10)4(11)5(12)6(13)7(14)15;1-2-4-5-3-1;/h2*2-5,8-12H,1H2,(H,14,15);1-5H;/q;;;+2/p-2/t2*2-,3+,4-,5+;;/s3 |
| InChIKey |
SOQQDHLKEJSCGV-YXWFMKNINA-L |
| SMILES |
[Mg+2].O=C(C([O-])=O)[C@H]([C@@H]([C@H]([C@@H](CO)O)O)O)O.O=C(C([O-])=O)[C@H]([C@@H]([C@H]([C@@H](CO)O)O)O)O.N1C=CC=C1 |&1:6,7,8,9,21,22,23,24,r| |
| LogP |
-2.387 (est) |
| CAS DataBase Reference |
62003-27-4 |
