Calcium Levulinate
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Product Description
Product
Calcium Levulinate
CAS
591-64-0
Formula
C10H14CaO6; C5H8O3.1/2Ca
Synonym
Calcium levulinate; Calcium pharmacon; calcium4-oxopentanoate; Calcium-acetopropionate; calciumbis(4-oxovalerate); calcium-diasporal; Calciumlevulate; calciumpharmacon; EINECS 209-725-9; Flanthin; Laevucalcin; Levucal; Levulin calcid; Levulinic acid, calcium salt; Mil-U-cal; Pentanoic acid, 4-oxo-, calcium salt; Pentanoic acid, 4-oxo-, calcium salt (2:1); UNII-LLQ966USIL; 4-oxo-pentanoicacicalciumsalt; 4-Oxopentanoicacidcalciumsalt; AI3-04042; Calcium 4-oxopentanoate; Calcium bis(4-oxovalerate)
Typical Product Specifications
Molecular weight
270.29
EINECS
209-725-9
SMILES
C(CCC(=O)[O-])(C)=O.C(CCC(=O)[O-])(C)=O.[Ca+2]
InChI
APKDPOQXVKRLEP-UHFFFAOYSA-L
InChIKey
1S/2C5H8O3.Ca/c2*1-4(6)2-3-5(7)8;/h2*2-3H2,1H3,(H,7,8);/q;;+2/p-2
log P (octanol-water)
-2.530
Atmospheric OH Rate Constant
4.19E-12 cm3/molecule-sec
Merck
1679
Water solubility
almost transparency
Melting Point
123 °C
Class
Calcium Levulinate
Product Description
Product
Calcium Levulinate
CAS
591-64-0
Formula
C10H14CaO6; C5H8O3.1/2Ca
Synonym
Calcium levulinate; Calcium pharmacon; calcium4-oxopentanoate; Calcium-acetopropionate; calciumbis(4-oxovalerate); calcium-diasporal; Calciumlevulate; calciumpharmacon; EINECS 209-725-9; Flanthin; Laevucalcin; Levucal; Levulin calcid; Levulinic acid, calcium salt; Mil-U-cal; Pentanoic acid, 4-oxo-, calcium salt; Pentanoic acid, 4-oxo-, calcium salt (2:1); UNII-LLQ966USIL; 4-oxo-pentanoicacicalciumsalt; 4-Oxopentanoicacidcalciumsalt; AI3-04042; Calcium 4-oxopentanoate; Calcium bis(4-oxovalerate)
Typical Product Specifications
Molecular weight
270.29
EINECS
209-725-9
SMILES
C(CCC(=O)[O-])(C)=O.C(CCC(=O)[O-])(C)=O.[Ca+2]
InChI
APKDPOQXVKRLEP-UHFFFAOYSA-L
InChIKey
1S/2C5H8O3.Ca/c2*1-4(6)2-3-5(7)8;/h2*2-3H2,1H3,(H,7,8);/q;;+2/p-2
log P (octanol-water)
-2.530
Atmospheric OH Rate Constant
4.19E-12 cm3/molecule-sec
Merck
1679
Water solubility
almost transparency
Melting Point
123 °C
Class
