1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetraacetic acid, 1-(2,5-dioxo-1-pyrrolidinyl) ester
Bezeichnung:1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetraacetic acid, 1-(2,5-dioxo-1-pyrrolidinyl) ester
CAS-Nr170908-81-3
Englisch Name:1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetraacetic acid, 1-(2,5-dioxo-1-pyrrolidinyl) ester
CBNumberCB02548816
SummenformelC20H31N5O10
Molgewicht501.49
MOL-Datei170908-81-3.mol
1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetraacetic acid, 1-(2,5-dioxo-1-pyrrolidinyl) ester physikalisch-chemischer Eigenschaften
| Siedepunkt | 743.7±70.0 °C(Predicted) |
| Dichte | 1.51±0.1 g/cm3(Predicted) |
| Löslichkeit | DMSO: 50 mg/mL (99.70 mM) |
| pka | 2.46±0.10(Predicted) |
| Aggregatzustand | Solid |
| Farbe | White to off-white |
| InChI | InChI=1S/C20H31N5O10/c26-15-1-2-16(27)25(15)35-20(34)14-24-9-7-22(12-18(30)31)5-3-21(11-17(28)29)4-6-23(8-10-24)13-19(32)33/h1-14H2,(H,28,29)(H,30,31)(H,32,33) |
| InChIKey | XSVWFLQICKPQAA-UHFFFAOYSA-N |
| SMILES | N1(CC(ON2C(=O)CCC2=O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC1 |