bis([(2,2-dimethylpropanoyl)oxy]rhodio 2,2-dimethylpropanoate)

• ChemBase ID: 144997
• Molecular Formular: C20H36O8Rh2
• Molecular Mass: 610.30604
• Monoisotopic Mass: 610.05202611
• SMILES: CC(C)(C)C(=O)O[Rh]OC(=O)C(C)(C)C.CC(C)(C)C(=O)O[Rh]OC(=O)C(C)(C)C
• Canonical SMILES: O=C(C(C)(C)C)O[Rh]OC(=O)C(C)(C)C.O=C(C(C)(C)C)O[Rh]OC(=O)C(C)(C)C
• InChI: InChI=1S/4C5H10O2.2Rh/c4*1-5(2,3)4(6)7;;/h4*1-3H3,(H,6,7);;/q;;;;2*+2/p-4
• InChIKey: DNBBTEHLBVKPEO-UHFFFAOYSA-J

NAMES AND DATABASE IDS

Names

• IUPAC name: bis([(2,2-dimethylpropanoyl)oxy]rhodio 2,2-dimethylpropanoate)
• IUPAC Traditional name: bis([(2,2-dimethylpropanoyl)oxy]rhodio 2,2-dimethylpropanoate)
• Synonyms: Tetrakis(pentanoato)dirhodium; Rhodium(II) trimethylacetate, dimer; 三甲基乙酸铑(II)二聚体

Database IDs

• CAS Number: 62728-88-5
• PubChem SID: 162239207; 24873421
• PubChem CID: 11104042

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 3.598
• LogD (pH = 7.4): 3.598
• Log P: 3.598
• Molar Refractivity: 50.837 cm^3
• Polarizability: 25.287977 Å^3
• Polar Surface Area: 52.6 Å^2
• Rotatable Bonds: 12
• Lipinski's Rule of Five: false

PROPERTIES

Safety Information

• RTECS: VI9361800
• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 36/37/38
• Safety Statements: 26-36
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305 + P351 + P338
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves

Product Information

• Purity: ≥99.9% trace metals basis
• Linear Formula: [[(CH3)3CCO2]2Rh]2

DETAILS

Sigma Aldrich - 511099

Packaging
1 g in glass bottle