triiodoindigane

• ChemBase ID: 110326
• Molecular Formular: I3In
• Molecular Mass: 495.53141
• Monoisotopic Mass: 495.617297
• SMILES: I[In](I)I
• Canonical SMILES: I[In](I)I
• InChI: InChI=1S/3HI.In/h3*1H;/q;;;+3/p-3
• InChIKey: RMUKCGUDVKEQPL-UHFFFAOYSA-K

NAMES AND DATABASE IDS

Names

• IUPAC name: triiodoindigane
• IUPAC Traditional name: triiodoindigane
• Synonyms: Indium(III) iodide; INDIUM TRIIODIDE; 碘化铟(III)

Database IDs

• CAS Number: 13510-35-5
• EC Number: 236-839-6
• MDL Number: MFCD00016151
• PubChem SID: 162095969; 24865877
• PubChem CID: 83539

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 2.8008
• LogD (pH = 7.4): 2.8008
• Log P: 2.8008
• Molar Refractivity: 40.0224 cm^3
• Polarizability: 22.796944 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: powder

Safety Information

• European Hazard Symbols: Harmful (Xn)
• German water hazard class: 3
• Risk Statements: 63-42/43
• Safety Statements: 22-26-36/37/39
• GHS Pictograms: GHS07; GHS08
• GHS Signal Word: Warning
• GHS Hazard statements: H317-H361
• GHS Precautionary statements: P280
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Faceshields, Gloves

Product Information

• Purity: 99.998% trace metals basis
• Grade: anhydrous
• Linear Formula: InI3

DETAILS

MP Biomedicals - 05214557

MP Biomedicals Rare Chemical collection

Sigma Aldrich - 413666

Application
Used to prepare vinyl and methyl indates which undergo regioselective reactions with cinnamyl bromide.1
Packaging
1, 5 g in ampule