Molecule structure of Ethyl potassium malonate (CAS NO.6148-64-7):
IUPAC Name: 3-Ethoxy-3-oxopropanoic acid; potassium
Molecular Weight: 171.21292 g/mol
Molecular Formula: C5H8KO4
Melting Point: 194 °C (dec.)(lit.)
Water Solubility: soluble
Sensitive: hygroscopic
H-Bond Donor: 1
H-Bond Acceptor: 4
Rotatable Bond Count: 4
Tautomer Count: 2
Exact Mass: 171.005966
MonoIsotopic Mass: 171.005966
Topological Polar Surface Area: 63.6
Heavy Atom Count: 10
Canonical SMILES: CCOC(=O)CC(=O)O.[K]
InChI: InChI=1S/C5H8O4.K/c1-2-9-5(8)3-4(6)7;/h2-3H2,1H3,(H,6,7);
InChIKey: HRBCMCJOBRIIQG-UHFFFAOYSA-N
EINECS: 228-156-7
Product Categories: Pharmaceutical Intermediates
Hazard Codes: Xi
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36-37/39
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36:Wear suitable protective clothing.
S37/39:Wear suitable gloves and eye/face protection.
WGK Germany: 2
HS Code: 29171910
Ethyl potassium malonate (CAS NO.6148-64-7) is also named as Potassium monoethyl malonate ; Potassium ethyl malonate ; Monoethyl malonate potassium ; Monoethyl malonate potassium salt ; Malonic acid monoethyl ester potassium salt ; Ethyl malonate monopotassium salt . Ethyl potassium malonate (CAS NO.6148-64-7) is white crystals or powder.
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