dibromo(fluoro)methane

• ChemBase ID: 126963
• Molecular Formular: CHBr2F
• Molecular Mass: 191.8250432
• Monoisotopic Mass: 189.84290225
• SMILES: BrC(Br)F
• Canonical SMILES: FC(Br)Br
• InChI: InChI=1S/CHBr2F/c2-1(3)4/h1H
• InChIKey: LTUTVFXOEGMHMP-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: dibromo(fluoro)methane
• IUPAC Traditional name: dibromofluoromethane
• Synonyms: Fluorodibromomethane; Dibromofluoromethane

Database IDs

• CAS Number: 1868-53-7
• PubChem SID: 162221287
• PubChem CID: 61280
• Chemspider ID: 55219
• Unique Ingredient Identifier: B0517W9BLP
• Wikipedia Title: Dibromofluoromethane

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 1.9193596
• LogD (pH = 7.4): 1.9193596
• Log P: 1.9193596
• Molar Refractivity: 22.1495 cm^3
• Polarizability: 8.911334 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: Insoluble in water
• Apperance: Liquid
• Melting Point: -78 °C
• Boiling Point: 64.9 °C
• Density: 2.421 g/cm^3 at 20 °C