platinum(2+) ion bis((2Z)-4-oxopent-2-en-2-olate)

• ChemBase ID: 302725
• Molecular Formular: C10H14O4Pt
• Molecular Mass: 393.29376
• Monoisotopic Mass: 393.05399993
• SMILES: C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].[Pt+2]
• Canonical SMILES: [O-]/C(=C\C(=O)C)/C.[O-]/C(=C\C(=O)C)/C.[Pt+2]
• InChI: InChI=1S/2C5H8O2.Pt/c2*1-4(6)3-5(2)7;/h2*3,6H,1-2H3;/q;;+2/p-2/b2*4-3-
• InChIKey: KLFRPGNCEJNEKU-FDGPNNRMSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: platinum(2+) ion bis((2Z)-4-oxopent-2-en-2-olate)
• IUPAC Traditional name: platinum(2+) ion bis((2Z)-4-oxopent-2-en-2-olate)
• Synonyms: Platinum(II) acetylacetonate; Platinum(II) 2,4-pentanedionate; 乙酰丙酮铂(II)

Database IDs

• CAS Number: 15170-57-7
• EC Number: 239-223-5
• MDL Number: MFCD00000028

CALCULATED PROPERTIES

• Acid pKa: 9.890059
• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 0.34448203
• LogD (pH = 7.4): 0.34309724
• Log P: 0.3444997
• Molar Refractivity: 39.1896 cm^3
• Polarizability: 10.113493 Å^3
• Polar Surface Area: 40.13 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: Very soluble in chloroform
• Apperance: Needles
• Melting Point: 250-252°C

Safety Information

• European Hazard Symbols: X
• Risk Statements: 20/22-36/38-43
• Safety Statements: 24-26-37
• TSCA Listed: 是
• GHS Pictograms: GHS06
• GHS Hazard statements: H301-H332-H315-H319-H317
• GHS Precautionary statements: P261-P301+P310-P305+P351+P338-P302+P352-P405-P501A

Product Information

• Purity: Pt 48.0% min