Calcium Bis[1,4,5,6-Tetrahydro-5-Sec-Butyl-5-Ethyl-1-Methyl-4,6-Dioxopyrimidine-2-Olate]
[CAS# 67050-27-5]

Identification

• Name: Calcium Bis[1,4,5,6-Tetrahydro-5-Sec-Butyl-5-Ethyl-1-Methyl-4,6-Dioxopyrimidine-2-Olate]
• Synonyms: Calcium 5-Ethyl-1-Methyl-4,6-Dioxo-5-Sec-Butyl-Pyrimidin-2-Olate; Calcium 5-Ethyl-1-Methyl-4,6-Dioxo-5-Sec-Butyl-2-Pyrimidinolate; Calcium 5-Ethyl-4,6-Diketo-1-Methyl-5-Sec-Butyl-Pyrimidin-2-Olate
• Molecular Formula: C₂₂H₃₄CaN₄O₆
• Molecular Weight: 490.61
• CAS Registry Number: 67050-27-5
• SMILES: [N-]1C(=O)C(C(=O)N(C1=O)C)(C(CC)C)CC.[N-]2C(=O)C(C(=O)N(C2=O)C)(C(CC)C)CC.[Ca++]
• InChI: 1S/2C11H18N2O3.Ca/c2*1-5-7(3)11(6-2)8(14)12-10(16)13(4)9(11)15;/h2*7H,5-6H2,1-4H3,(H,12,14,16);/q;;+2/p-2
• InChIKey: KGISGVJYCVQRHS-UHFFFAOYSA-L

Properties

• Boiling point: 325.7°C at 760 mmHg (Cal.)
• Flash point: 150.8°C (Cal.)