Tri-tert-Butyl 1,4,7,10-tetraazacyclododecane-1,4,7-tricarboxylate

Catalog Number	ACM175854394-1
CAS	175854-39-4
Structure
Synonyms	1,4,7-Tri-Boc-1,4,7,10-Tetraazacyclododecane; 1,4,7-Tris-Boc-1,4,7,10-Tetraaza-Cyclododecane; N,N',N''-Tri-Boc-cyclen
IUPAC Name	tritert-butyl 1,4,7,10-tetrazacyclododecane-1,4,7-tricarboxylate
Molecular Weight	472.62
Molecular Formula	C23H44N4O6
InChI	ZXASHTYJQJMCQR-UHFFFAOYSA-N
InChI Key	InChI=1S/C23H44N4O6/c1-21(2,3)31-18(28)25-12-10-24-11-13-26(19(29)32-22(4,5)6)15-17-27(16-14-25)20(30)33-23(7,8)9/h24H,10-17H2,1-9H3
Boiling Point	541.1 °C at 760 mmHg
Melting Point	72-73 °C
Purity	97%
Appearance	White powder
Isomeric SMILES	CC(C)(C)OC(=O)N1CCNCCN(CCN(CC1)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C