2,8-diethoxy-4,10-dimethyl-1$l^{3},5$l^{3}-dioxa-7$l^{3},11$l^{3}-dioxa-6-cupraspiro[5.5]undeca-1,4,7,10-tetraene

• ChemBase ID: 109404
• Molecular Formular: C12H20CuO6
• Molecular Mass: 323.8296
• Monoisotopic Mass: 323.05558586
• SMILES: CCOC1=[O][Cu]2([O]=C(C)C1)[O]=C(C)CC(=[O]2)OCC
• Canonical SMILES: CCOC1=[O][Cu]2([O]=C(C1)C)[O]=C(C)CC(=[O]2)OCC
• InChI: InChI=1S/2C6H10O3.Cu/c2*1-3-9-6(8)4-5(2)7;/h2*3-4H2,1-2H3
• InChIKey: AUBDNJOVKJMDLN-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2,8-diethoxy-4,10-dimethyl-1$l^{3},5$l^{3}-dioxa-7$l^{3},11$l^{3}-dioxa-6-cupraspiro[5.5]undeca-1,4,7,10-tetraene
• IUPAC Traditional name: 2,8-diethoxy-4,10-dimethyl-1$l^{3},5$l^{3}-dioxa-7$l^{3},11$l^{3}-dioxa-6-cupraspiro[5.5]undeca-1,4,7,10-tetraene
• Synonyms: COPPER ETHYLACETOACETATE

Database IDs

• CAS Number: 14284-06-1
• EC Number: 238-181-5
• PubChem SID: 162094817
• PubChem CID: 428901

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• Molar Refractivity: 110.8012 cm^3
• Polar Surface Area: 155.02 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: false

PROPERTIES

Safety Information

• European Hazard Symbols: Nature polluting (N); Irritant (Xi)
• Risk Statements: R:36/37/38-58
• Safety Statements: S:20-25-26-37/39-61

DETAILS

MP Biomedicals - 05210894

MP Biomedicals Rare Chemical collection