Calcobutrol

cas: 151878-23-8 — see every product listed under this CAS number, including other names

Calcobutrol (CAS 151878-23-8) is a chemical reagent available from Chemat. Available pack sizes: 0,25g, 0,1g, 0,5g, 1g. Offered by: Biosynth.

brandBiosynth
catalog numberFC176827-0,25g
cas151878-23-8
size0,25g
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properties

categoryResearch Chemicals
purityNo data
delivery time1-2 weeks
Structural formula: {0} (CAS {1})

Calcium;2-[4,10-bis(carboxylatomethyl)-7-[(2R,3S)-1,3,4-trihydroxybutan-2-yl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;hydron (CAS 151878-23-8) is a chemical compound with the molecular formula C18H32CaN4O9 and a molecular weight of 488.5 g/mol. IUPAC name: calcium;2-[4,10-bis(carboxylatomethyl)-7-[(2R,3S)-1,3,4-trihydroxybutan-2-yl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;hydron. InChIKey: GCLKDXFGQNCFQW-CTHHTMFSSA-L.

Identity
Molecular formulaC18H32CaN4O9
Molecular weight488.5 g/mol
IUPAC namecalcium;2-[4,10-bis(carboxylatomethyl)-7-[(2R,3S)-1,3,4-trihydroxybutan-2-yl]-1,4,7,10-tetrazacyclododec-1-yl]acetate;hydron
InChIKeyGCLKDXFGQNCFQW-CTHHTMFSSA-L
SMILES[H+].C1CN(CCN(CCN(CCN1CC(=O)[O-])CC(=O)[O-])[C@H](CO)[C@@H](CO)O)CC(=O)[O-].[Ca+2]

Computed by PubChem (NCBI)

Synonyms: Calcobutrol, Calcobutrol [INN], Calciumbutrol, CALCOBUTROLUM
Related forms of this compound
calcium 2-[4-(carboxylatomethyl)-10-(carboxymethyl)-7-[(2R,3S)-1,3,4-trihydroxybutan-2-yl]-1,4,7,10-tetrazacyclododec-1-yl]acetate C18H32CaN4O9

Also listed as

Calcobutrol, >95% (HPLC) TRC CAS 151878-23-8
Calcobutrol 98% Ambeed CAS 151878-23-8
rel-10-[(1R,2S)-2,3-Dihydroxy-1-(hydroxymethyl)propyl]-1,4,7,10-tetraazacyclododecane-1,4,7-triacetic acid, calcium salt, 98%, 98% Chemat CAS 151878-23-8