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Copper terephthalate trihydrate

Catalog Number ACM28758103-1
CAS 28758-10-3
Structure Copper terephthalate trihydrate
Synonyms Terephthalic acid, copper(II) salt, trihydrate
Molecular Weight 281.71
Molecular Formula C8H10CuO7
Canonical SMILES C1=CC(=CC=C1C(=O)[O-])C(=O)[O-].O.O.O.[Cu+2]
InChI InChI=1S/C8H6O4.Cu.3H2O/c9-7(10)5-1-2-6(4-3-5)8(11)12;/h1-4H,(H,9,10)(H,11,12);3*1H2/q;+2;/p-2
InChI Key ZUPWZZARYZSUME-UHFFFAOYSA-L
Purity 98%
Exact Mass 280.97225
Hydrogen Bond Acceptor Count 7
Hydrogen Bond Donor Count 3
Monoisotopic Mass 280.97225
Rotatable Bond Count 0
Topological Polar Surface Area 83.3 Ų

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