1,4,7,10-Tetraazacyclotridecane-4,7-diacetic acid, 2,9-dioxo-
2-[7-(carboxymethyl)-2,9-dioxo-1,4,7,10-tetrazacyclotridec-4-yl]acetic acid
Also Known As: ACMC-20lwyy|1,4,7,10-Tetraazacyclotridecane-4,7-diacetic acid, 2,9-dioxo-|1,4,7,10-Tetraazacyclotridecane-4,7-diacetic acid,2,9-dioxo|2,9-Dioxo-1,4,7,10-tetraazacyclotridecane-4,7-diacetic acid|2-[7-(carboxymethyl)-2,9-dioxo-1,4,7,10-tetrazacyclotridec-4-yl]acetic Acid|6,12-Dioxo-1,4,7,11-tetraazacyclotridecane-1,4-bisacetic acid|6,12-Dioxo-1,4,7,11-tetraazacyclotridecane-1,4-diacetic acid|2,2'-(2,9-Dioxo-1,4,7,10-tetraazacyclotridecane-4,7-diyl)diacetic acid|2-[7-(carboxymethyl)-2,9-dioxo-1,4,7,10-tetraazacyclotridecan-4-yl]acetic acid
| Molecular Formula | C13H22N4O6 |
|---|---|
| Molecular Weight | 330.15393 g/mol |
| LogP | -2.6043 |
| Topological Polar Surface Area | 139.28 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.15393 |
| Monoisotopic Mass | 330.15393 |
| Heavy Atoms | 23 |
| Complexity | 415.7457 |
Chemical Identifiers
| CAS Number | 93031-56-2 |
|---|---|
| SMILES | C1CNC(=O)CN(CCN(CC(=O)NC1)CC(=O)O)CC(=O)O |
Product Overview
1,4,7,10-Tetraazacyclotridecane-4,7-diacetic acid, 2,9-dioxo- (CAS 93031-56-2), with molecular formula C13H22N4O6 and molecular weight 330.15393 g/mol. IUPAC: 2-[7-(carboxymethyl)-2,9-dioxo-1,4,7,10-tetrazacyclotridec-4-yl]acetic acid.