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Calcium levulinate dihydrate Structure

Calcium levulinate dihydrate

Chemical Properties

Melting point 121.0 to 125.0 °C
storage temp.  Store at room temperature
solubility  Freely soluble in water, very slightly soluble in ethanol (96 per cent), practically insoluble in methylene chloride.
Merck  14,1679
BRN  3764203
InChI InChI=1S/2C5H8O3.Ca/c2*1-4(6)2-3-5(7)8;/h2*2-3H2,1H3,(H,7,8);/q;;+2/p-2
InChIKey APKDPOQXVKRLEP-UHFFFAOYSA-L
SMILES C(=O)(O[Ca]OC(=O)CCC(=O)C)CCC(=O)C
LogP -0.490 (est)
FDA UNII T6133SO781

Safety

WGK Germany  3
RTECS  SA4000000
HS Code  2918300000

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