p-SCN-Bn-DOTA (Standard)

cas: 127985-74-4 — see every product listed under this CAS number, including other names

p-SCN-Bn-DOTA (Standard) (CAS 127985-74-4) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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2-[4,7,10-tris(carboxymethyl)-6-[(4-isothiocyanatophenyl)methyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid (CAS 127985-74-4) is a chemical compound with the molecular formula C24H33N5O8S and a molecular weight of 551.6 g/mol. IUPAC name: 2-[4,7,10-tris(carboxymethyl)-6-[(4-isothiocyanatophenyl)methyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid. InChIKey: UDOPJKHABYSVIX-UHFFFAOYSA-N.

Identity
Molecular formulaC24H33N5O8S
Molecular weight551.6 g/mol
IUPAC name2-[4,7,10-tris(carboxymethyl)-6-[(4-isothiocyanatophenyl)methyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid
InChIKeyUDOPJKHABYSVIX-UHFFFAOYSA-N
SMILESC1CN(CCN(C(CN(CCN1CC(=O)O)CC(=O)O)CC2=CC=C(C=C2)N=C=S)CC(=O)O)CC(=O)O

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