λ1-indiganyliumylidene bromide

• ChemBase ID: 303365
• Molecular Formular: BrIn
• Molecular Mass: 194.722
• Monoisotopic Mass: 193.822215
• SMILES: [Br-].[In+]
• Canonical SMILES: [Br-].[In+]
• InChI: InChI=1S/BrH.In/h1H;/q;+1/p-1
• InChIKey: KLRHPHDUDFIRKB-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: λ^1-indiganyliumylidene bromide
• IUPAC Traditional name: λ^1-indiganyliumylidene bromide
• Synonyms: Indium(I) bromide, ultra dry; Indium(I) bromide, Puratronic®; 溴化亚铟(I), 超干; 溴化亚铟(I), Puratronic®

Database IDs

• CAS Number: 14280-53-6
• EC Number: 238-172-6
• MDL Number: MFCD00064630

CALCULATED PROPERTIES

• Acid pKa: -8.0
• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 1.0182534
• LogD (pH = 7.4): 1.0182534
• Log P: 0.797834
• Molar Refractivity: 8.5991 cm^3
• Polarizability: 3.2406807 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: -10 Mesh Beads, Ampouled under argon; Polycrystalline Lump
• Melting Point: 220°C
• Boiling Point: 662°C
• Density: 4.96

Safety Information

• Storage Warning: Moisture Sensitive
• European Hazard Symbols: Corrosive (C)
• UN Number: UN3260
• Hazard Class: 8
• Packing Group: III
• Risk Statements: 34
• Safety Statements: 20-26-36/37/39-45-60
• TSCA Listed: 否
• GHS Pictograms: GHS05
• GHS Hazard statements: H314-H318
• GHS Precautionary statements: P260-P303+P361+P353-P305+P351+P338-P301+P330+P331-P405-P501A

Product Information

• Purity: 99.998% (metals basis); 99.999% (metals basis)