Products 1412494-57-5

CAS 1412494-57-5 is the registry number for DOTA-tri(alpha-cumyl Ester). Offered by: TRC. Available pack sizes: 500mg.

Structural formula: {0} (CAS {1})

2-[4,7,10-tris[2-oxo-2-(2-phenylpropan-2-yloxy)ethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid (CAS 1412494-57-5) is a chemical compound with the molecular formula C43H58N4O8 and a molecular weight of 758.9 g/mol. IUPAC name: 2-[4,7,10-tris[2-oxo-2-(2-phenylpropan-2-yloxy)ethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid. InChIKey: MTDPBSZDRLCVKI-UHFFFAOYSA-N.

Identity
Molecular formulaC43H58N4O8
Molecular weight758.9 g/mol
IUPAC name2-[4,7,10-tris[2-oxo-2-(2-phenylpropan-2-yloxy)ethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid
InChIKeyMTDPBSZDRLCVKI-UHFFFAOYSA-N
SMILESCC(C)(C1=CC=CC=C1)OC(=O)CN2CCN(CCN(CCN(CC2)CC(=O)OC(C)(C)C3=CC=CC=C3)CC(=O)OC(C)(C)C4=CC=CC=C4)CC(=O)O

Computed by PubChem (NCBI)