di(hexanoyloxy)rhodio hexanoate

• ChemBase ID: 148532
• Molecular Formular: C24H44O8Rh2
• Molecular Mass: 666.41236
• Monoisotopic Mass: 666.11462637
• SMILES: CCCCCC(=O)O[Rh]OC(=O)CCCCC.CCCCCC(=O)O[Rh]OC(=O)CCCCC
• Canonical SMILES: CCCCCC(=O)O[Rh]OC(=O)CCCCC.CCCCCC(=O)O[Rh]OC(=O)CCCCC
• InChI: InChI=1S/4C6H12O2.2Rh/c4*1-2-3-4-5-6(7)8;;/h4*2-5H2,1H3,(H,7,8);;/q;;;;2*+2/p-4
• InChIKey: FNSGZOCUBHMUMB-UHFFFAOYSA-J

NAMES AND DATABASE IDS

Names

• IUPAC name: di(hexanoyloxy)rhodio hexanoate
• IUPAC Traditional name: di(hexanoyloxy)rhodio hexanoate
• Synonyms: Rhodium(II) hexanoate, dimer; 己酸铑(II)二聚体

Database IDs

• CAS Number: 62728-89-6
• MDL Number: MFCD00064723
• PubChem SID: 24871744; 162242707
• PubChem CID: 71311345

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 3.5208
• LogD (pH = 7.4): 3.5208
• Log P: 3.5208
• Molar Refractivity: 60.292 cm^3
• Polarizability: 28.897 Å^3
• Polar Surface Area: 52.6 Å^2
• Rotatable Bonds: 24
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Apperance: solid
• Melting Point: 130-136 °C(lit.)

Safety Information

• RTECS: VI9361400
• 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: 97%
• Linear Formula: [[CH3(CH2)4CO2]2Rh]2

DETAILS

Sigma Aldrich - 481173

Packaging
1 g in glass bottle