magnesium;hydride;tris(2,2,2-trifluoroacetic acid)

C6H5F9MgO6 — CID 173424393

IUPACmagnesium;hydride;tris(2,2,2-trifluoroacetic acid)
SMILESO=C(O)C(F)(F)F.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.[H-].[H-].[Mg+2]
InChIInChI=1S/3C2HF3O2.Mg.2H/c3*3-2(4,5)1(6)7;;;/h3*(H,6,7);;;/q;;;+2;2*-1
InChIKeyJKPLQUBJAYFTTL-UHFFFAOYSA-N
MW368.39 g/mol
LogP1.74
Rot. Bonds

About magnesium;hydride;tris(2,2,2-trifluoroacetic acid)

magnesium;hydride;tris(2,2,2-trifluoroacetic acid) (PubChem CID 173424393) has the molecular formula C6H5F9MgO6 and a molecular weight of 368.39 g/mol. Its IUPAC name is magnesium;hydride;tris(2,2,2-trifluoroacetic acid).

Molecular Properties

Compound Namemagnesium;hydride;tris(2,2,2-trifluoroacetic acid)
PubChem CID173424393
Molecular FormulaC6H5F9MgO6
Molecular Weight368.39 g/mol
Exact Mass367.98
IUPAC Namemagnesium;hydride;tris(2,2,2-trifluoroacetic acid)
SMILESO=C(O)C(F)(F)F.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.[H-].[H-].[Mg+2]
InChIInChI=1S/3C2HF3O2.Mg.2H/c3*3-2(4,5)1(6)7;;;/h3*(H,6,7);;;/q;;;+2;2*-1
InChIKeyJKPLQUBJAYFTTL-UHFFFAOYSA-N
XLogP1.74
TPSA111.90 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.39
LogP ≤ 51.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze magnesium;hydride;tris(2,2,2-trifluoroacetic acid) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

magnesium;hydride;bis(2,2,2-trifluoroacetic acid)
CID 173420344
azane;tris(2,2,2-trifluoroacetic acid)
CID 175976837
erbium;tris(2,2,2-trifluoroacetic acid)
CID 118855690
azane;pentakis(2,2,2-trifluoroacetic acid)
CID 174693543
2,2,2-trifluoroacetic acid;trihydrofluoride
CID 171927516
CID 85392225
CID 85392225
sulfanium 2,2,2-trifluoroacetic acid
CID 158048002
bis(oxygen(2-));titanium(4+);2,2,2-trifluoroacetic acid
CID 157338255
CID 159010746
CID 159010746
copper;2,2,2-trifluoroacetic acid;tetrahydrate
CID 175128506
oxophosphanium;2,2,2-trifluoroacetic acid
CID 175810301
bis(propan-2-one);2,2,2-trifluoroacetic acid
CID 175331855

Frequently Asked Questions

What is the IUPAC name of magnesium;hydride;tris(2,2,2-trifluoroacetic acid)?
The IUPAC name of magnesium;hydride;tris(2,2,2-trifluoroacetic acid) (CID 173424393) is magnesium;hydride;tris(2,2,2-trifluoroacetic acid).
What is the SMILES notation for magnesium;hydride;tris(2,2,2-trifluoroacetic acid)?
The canonical SMILES for magnesium;hydride;tris(2,2,2-trifluoroacetic acid) is O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.[H-].[H-].[Mg+2].
What is the InChIKey of magnesium;hydride;tris(2,2,2-trifluoroacetic acid)?
The InChIKey is JKPLQUBJAYFTTL-UHFFFAOYSA-N. The full InChI is InChI=1S/3C2HF3O2.Mg.2H/c3*3-2(4,5)1(6)7;;;/h3*(H,6,7);;;/q;;;+2;2*-1.
What are the key properties of magnesium;hydride;tris(2,2,2-trifluoroacetic acid)?
magnesium;hydride;tris(2,2,2-trifluoroacetic acid) has a molecular weight of 368.39 g/mol, XLogP of 1.74, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;hydride;tris(2,2,2-trifluoroacetic acid) is sourced from PubChem (CID 173424393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).