trichlororhodium hydrate

• ChemBase ID: 148478
• Molecular Formular: Cl3H2ORh
• Molecular Mass: 227.27978
• Monoisotopic Mass: 225.82262672
• SMILES: O.Cl[Rh](Cl)Cl
• Canonical SMILES: Cl[Rh](Cl)Cl.O
• InChI: InChI=1S/3ClH.H2O.Rh/h3*1H;1H2;/q;;;;+3/p-3
• InChIKey: HSSMNYDDDSNUKH-UHFFFAOYSA-K

NAMES AND DATABASE IDS

Names

• IUPAC name: trichlororhodium hydrate
• IUPAC Traditional name: trichlororhodium hydrate
• Synonyms: Rhodium trichloride hydrate; Rhodium(III) chloride hydrate; 氯化铑(III) 水合物

Database IDs

• CAS Number: 20765-98-4
• EC Number: 233-165-4
• MDL Number: MFCD00149839
• PubChem SID: 24874167; 162242653; 24852390; 24868236
• PubChem CID: 16211510

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 1.9035
• LogD (pH = 7.4): 1.9035
• Log P: 1.9035
• Molar Refractivity: 18.4089 cm^3
• Polarizability: 11.807289 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: crystalline; powder or crystals
• Melting Point: 100 °C (dec.)(lit.)

Safety Information

• European Hazard Symbols: Harmful (Xn)
• German water hazard class: 3
• Risk Statements: 22-41
• Safety Statements: 26-36/39
• GHS Pictograms: GHS05; GHS07
• GHS Signal Word: Danger
• GHS Hazard statements: H302-H318
• GHS Precautionary statements: P280-P305 + P351 + P338
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves

Product Information

• Purity: ≥99.9% trace metals basis; 99.98% trace metals basis
• Compostion: Rh, 38-40%; Rh, 38-43.5%; Rh, 40%
• Linear Formula: RhCl3 · xH2O

DETAILS

Sigma Aldrich - 450286

Packaging
1 g in glass bottle
250 mg in glass bottle

Sigma Aldrich - 206261

Application
Catalyst for conjugate reduction of cinnamaldehydes followed by cross-coupling with arylboronic acids.1
Catalyst for the direct conversion of methane to acetic acid.
Catalyst for the isomerization of alkenes, the reduction of aromatic rings, the oxidation ofalkenes, the hydration of acetylene, the hydrosilylation of α,β-unsaturated esters to form dimethylketene trimethylsilyl acetals.
Packaging
1, 5, 10, 25 g in glass bottle
250 mg in glass bottle

Sigma Aldrich - 520772

Packaging
1, 5 g in glass bottle