magnesium;1-bromo-1,1,2,2,2-pentafluoroethane;hydride

C2H2BrF5Mg — CID 173236126

IUPACmagnesium;1-bromo-1,1,2,2,2-pentafluoroethane;hydride
SMILESFC(F)(F)C(F)(F)Br.[H-].[H-].[Mg+2]
InChIInChI=1S/C2BrF5.Mg.2H/c3-1(4,5)2(6,7)8;;;/q;+2;2*-1
InChIKeyFUUBQCQGXSWEQW-UHFFFAOYSA-N
MW225.24 g/mol
LogP2.38
Rot. Bonds

About magnesium;1-bromo-1,1,2,2,2-pentafluoroethane;hydride

magnesium;1-bromo-1,1,2,2,2-pentafluoroethane;hydride (PubChem CID 173236126) has the molecular formula C2H2BrF5Mg and a molecular weight of 225.24 g/mol. Its IUPAC name is magnesium;1-bromo-1,1,2,2,2-pentafluoroethane;hydride.

Molecular Properties

Compound Namemagnesium;1-bromo-1,1,2,2,2-pentafluoroethane;hydride
PubChem CID173236126
Molecular FormulaC2H2BrF5Mg
Molecular Weight225.24 g/mol
Exact Mass223.91
IUPAC Namemagnesium;1-bromo-1,1,2,2,2-pentafluoroethane;hydride
SMILESFC(F)(F)C(F)(F)Br.[H-].[H-].[Mg+2]
InChIInChI=1S/C2BrF5.Mg.2H/c3-1(4,5)2(6,7)8;;;/q;+2;2*-1
InChIKeyFUUBQCQGXSWEQW-UHFFFAOYSA-N
XLogP2.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.24
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of magnesium;1-bromo-1,1,2,2,2-pentafluoroethane;hydride?
The IUPAC name of magnesium;1-bromo-1,1,2,2,2-pentafluoroethane;hydride (CID 173236126) is magnesium;1-bromo-1,1,2,2,2-pentafluoroethane;hydride.
What is the SMILES notation for magnesium;1-bromo-1,1,2,2,2-pentafluoroethane;hydride?
The canonical SMILES for magnesium;1-bromo-1,1,2,2,2-pentafluoroethane;hydride is FC(F)(F)C(F)(F)Br.[H-].[H-].[Mg+2].
What is the InChIKey of magnesium;1-bromo-1,1,2,2,2-pentafluoroethane;hydride?
The InChIKey is FUUBQCQGXSWEQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C2BrF5.Mg.2H/c3-1(4,5)2(6,7)8;;;/q;+2;2*-1.
What are the key properties of magnesium;1-bromo-1,1,2,2,2-pentafluoroethane;hydride?
magnesium;1-bromo-1,1,2,2,2-pentafluoroethane;hydride has a molecular weight of 225.24 g/mol, XLogP of 2.38, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;1-bromo-1,1,2,2,2-pentafluoroethane;hydride is sourced from PubChem (CID 173236126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).