2,4,8,10-tetramethyl-1$l^{3},5$l^{3}-dioxa-7$l^{3},11$l^{3}-dioxa-6-nickelaspiro[5.5]undeca-1,4,7,10-tetraene-6,6-bis(ylium)-3,9-diide

• ChemBase ID: 110779
• Molecular Formular: C10H14NiO4
• Molecular Mass: 256.90916
• Monoisotopic Mass: 256.02455183
• SMILES: CC1=[O][Ni+2]2([O]=C(C)[CH-]1)[O]=C(C)[CH-]C(=[O]2)C
• Canonical SMILES: CC1=[O][Ni+2]2([O]=C([CH-]1)C)[O]=C(C)[CH-]C(=[O]2)C
• InChI: InChI=1S/2C5H7O2.Ni/c2*1-4(6)3-5(2)7;/h2*3H,1-2H3;/q2*-1;+2
• InChIKey: JBIMTYQVAYCSRC-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2,4,8,10-tetramethyl-1$l^{3},5$l^{3}-dioxa-7$l^{3},11$l^{3}-dioxa-6-nickelaspiro[5.5]undeca-1,4,7,10-tetraene-6,6-bis(ylium)-3,9-diide
• IUPAC Traditional name: 2,4,8,10-tetramethyl-1$l^{3},5$l^{3}-dioxa-7$l^{3},11$l^{3}-dioxa-6-nickelaspiro[5.5]undeca-1,4,7,10-tetraene-6,6-bis(ylium)-3,9-diide
• Synonyms: NICKEL ACETYLACETONATE (OUS)

Database IDs

• CAS Number: 3264-82-2
• EC Number: 221-875-7
• PubChem SID: 162096958
• PubChem CID: 2723707

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• Molar Refractivity: 96.4072 cm^3
• Polar Surface Area: 136.56 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: false

PROPERTIES

Safety Information

• RTECS: SA2100000
• European Hazard Symbols: Nature polluting (N); Harmful (Xn)
• Risk Statements: R:40-43-58
• Safety Statements: S:22-36-61

DETAILS

MP Biomedicals - 05216293

MP Biomedicals Rare Chemical collection