CAS Number: 151878-23-8
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CAS Number
151878-23-8
PubChem CID
76967066
Molecular Formula
C18H32CaN4O9
Molecular Weight
488.5 g/mol
Exact Mass
488.17952
InChIKey
GCLKDXFGQNCFQW-CTHHTMFSSA-L
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
SMILES String
O=C([O-])CN1CCN(CC(=O)[O-])CCN([C@H](CO)[C@H](O)CO)CCN(CC(=O)O)CC1.[Ca+2]
No physical property values available.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Structural features
Calcobutrol (CAS 151878-23-8) is listed in the Advanced Chemicals portfolio, with molecular formula C18H32CaN4O9 and molecular weight 488. 50 g/mol.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Intended for research building-block and synthetic chemistry workflows; structure-derived tags include nitrogen-containing heterocycle.
Documentation needs
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Preliminary Safety Reference
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Safety Reference / SDS RequestCatalog navigation
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Calcobutrol is identified by CAS 151878-23-8, with molecular formula C18H32CaN4O9, molecular weight 488.5, InChIKey GCLKDXFGQNCFQW-CTHHTMFSSA-L.
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
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