1,2-dibromo-1-fluoroethene

• ChemBase ID: 97324
• Molecular Formular: C2HBr2F
• Molecular Mass: 203.8357432
• Monoisotopic Mass: 201.84290225
• SMILES: Br/C=C(/Br)\F
• Canonical SMILES: Br/C=C(/Br)\F
• InChI: InChI=1S/C2HBr2F/c3-1-2(4)5/h1H
• InChIKey: SVTXQCIMTFGPTM-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1,2-dibromo-1-fluoroethene
• IUPAC Traditional name: 1,2-dibromo-1-fluoroethene
• Synonyms: 1,2-Dibromofluoroethylene

Database IDs

• MDL Number: MFCD02913516
• PubChem SID: 162083934
• PubChem CID: 15721051

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 2.2055063
• LogD (pH = 7.4): 2.2055063
• Log P: 2.2055063
• Molar Refractivity: 35.9589 cm^3
• Polarizability: 10.323845 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: Irritant