magnesium;1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propane;hydride

C4H3F9Mg — CID 175390788

IUPACmagnesium;1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propane;hydride
SMILESFC(F)(F)C(C(F)(F)F)C(F)(F)F.[H-].[H-].[Mg+2]
InChIInChI=1S/C4HF9.Mg.2H/c5-2(6,7)1(3(8,9)10)4(11,12)13;;;/h1H;;;/q;+2;2*-1
InChIKeyBTZONWHBIUYQNG-UHFFFAOYSA-N
MW246.35 g/mol
LogP3.13
Rot. Bonds

About magnesium;1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propane;hydride

magnesium;1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propane;hydride (PubChem CID 175390788) has the molecular formula C4H3F9Mg and a molecular weight of 246.35 g/mol. Its IUPAC name is magnesium;1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propane;hydride.

Molecular Properties

Compound Namemagnesium;1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propane;hydride
PubChem CID175390788
Molecular FormulaC4H3F9Mg
Molecular Weight246.35 g/mol
Exact Mass245.99
IUPAC Namemagnesium;1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propane;hydride
SMILESFC(F)(F)C(C(F)(F)F)C(F)(F)F.[H-].[H-].[Mg+2]
InChIInChI=1S/C4HF9.Mg.2H/c5-2(6,7)1(3(8,9)10)4(11,12)13;;;/h1H;;;/q;+2;2*-1
InChIKeyBTZONWHBIUYQNG-UHFFFAOYSA-N
XLogP3.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of magnesium;1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propane;hydride?
The IUPAC name of magnesium;1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propane;hydride (CID 175390788) is magnesium;1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propane;hydride.
What is the SMILES notation for magnesium;1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propane;hydride?
The canonical SMILES for magnesium;1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propane;hydride is FC(F)(F)C(C(F)(F)F)C(F)(F)F.[H-].[H-].[Mg+2].
What is the InChIKey of magnesium;1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propane;hydride?
The InChIKey is BTZONWHBIUYQNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4HF9.Mg.2H/c5-2(6,7)1(3(8,9)10)4(11,12)13;;;/h1H;;;/q;+2;2*-1.
What are the key properties of magnesium;1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propane;hydride?
magnesium;1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propane;hydride has a molecular weight of 246.35 g/mol, XLogP of 3.13, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propane;hydride is sourced from PubChem (CID 175390788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).