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2,4-Pentanedione calcium derivative
Catalog Number
ACM345909311-1
CAS
345909-31-1
IUPAC Name
Calcium;4-oxopent-2-en-2-olate;hydrate
Synonyms
Calcium acetylacetonate hydrate
Molecular Weight
256.31
Product Information
Canonical SMILES
CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].O.[Ca+2]
InChI
InChI=1S/2C5H8O2.Ca.H2O/c2*1-4(6)3-5(2)7;/h2*3,6H,1-2H3;1H2/q;+2;/p-2
InChI Key
FFWWBMKQRYMOKA-UHFFFAOYSA-L
Melting Point
>280 °C
Purity
95%+
Appearance
Solid
Complexity
90.4
Covalently-Bonded Unit Count
4
Exact Mass
256.0623645
Heavy Atom Count
16
Monoisotopic Mass
256.0623645
Topological Polar Surface Area
81.3 Ų
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